Ethylene glycol diacetate

HCID 8121CAS 111-55-7

Grundinformationen

Standard-SMILES
CC(=O)OCCOC(C)=O
InChIKey
JTXMVXSTHSMVQF-UHFFFAOYSA-N
Summenformel
C6H10O4
Durchschnittliche Molmasse
146,14 g/mol
Monoisotopische Masse
146,0579088

Namen und Bezeichner

Bevorzugter Name
Ethylene glycol diacetate
IUPAC
2-acetyloxyethyl acetate
Lokaler Name
Ethylendi(acetat)
Englischer Name
Ethylene glycol diacetate
Summenformel
C6H10O4
Molmasse
146.14

Namen und Synonyme

ETHYLENE GLYCOL DIACETATE111-55-7Glycol diacetate1,2-DiacetoxyethaneEthylene diacetate1,2-Ethanediol diacetateEthanediol diacetateEthylene acetateEthylene glycol, diacetateEthylene diethanoateAptex Donor H-plus1,2-Ethanediol, diacetate
Weitere Namen anzeigen
ETHANE-1,2-DIOLGLYCOLEGDAETHANEDIOL1,2-DIHYDROXYETHANE1,2-ETHANDIOL
Ethylene di(acetate)ethane-1,2-diyl diacetate9E5JC3Q7WJNSC 8853HSDB 430DTXSID0026880EINECS 203-881-1ETHYLENE GLYCOL ACETATE

Datenbank-Bezeichner

CAS
111-55-7、27252-83-1
PubChem CID
8121
DTXSID
DTXSID0026880
ChEMBL
CHEMBL3186227
UNII
9E5JC3Q7WJ
EC Number
203-881-1、630-394-5、937-889-8
Nikkaji
J10.596A

Eigenschaften

Berechnete Struktureigenschaften

XLogP
0
Polarare Oberfläche (TPSA)
52,6 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
4
Frei drehbare Bindungen
5
Schwere Atome
10

Experimentelle und physikochemische Eigenschaften

LogPLog Kow= 0.10/0.38 (calc)
Odor · 2 Einträge

SLIGHT ODOR OF ETHYL ACETATE

ACETIC, ESTERLIKE

TasteBITTER
Density · 4 Einträge

1.104 at 68 °F (USCG, 1999) - Denser than water; will sink

1.104

Bulk density = 9.2 lb/gal at 20 °C, freezing point = -31 °C

1.104 @25 °C

Color/FormCOLORLESS LIQ
Solubility · 5 Einträge

greater than or equal to 100 mg/mL at 68 °F (NTP, 1992)

MISCIBLE WITH ETHER

SOL IN ... ETHANOL AND ACETONE

16.4% IN WATER AT 20 °C

Water solubility = 1.78X10+5 mg/l at 24.5 °C

Physikochemische Eigenschaften

Schmelzpunkt
-41 °C · -41 °C (lit.)
Siedepunkt
186 · 186-187 °C (lit.)
Dichte
1.104 g/mL · 1.104 g/mL at 20 °C (lit.)
Dampfdichte
5.04 · 5.04 (vs air)
Dampfdruck
0.2 mm · 0.2 mm Hg ( 20 °C)
Brechungsindex
20 · n20/D 1.431(lit.)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

This chemical does not meet GHS hazard criteria for 70.5% (292 of 414) of all reports.

Warning

H315 (14%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (29.5%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (10.1%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 414 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 292 of 414 reports by companies.;There are 4 notifications provided by 122 of 414 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Gefahrenhinweise

Regulatory Information · 6 Einträge

Chemical: Poly(oxy-1,2-ethanediyl), .alpha.-acetyl-.omega.-(acetyloxy)-

Chemical: 1,2-Ethanediol, diacetate

1,2-Ethanediol, 1,2-diacetate is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,2-Ethanediol, 1,2-diacetate are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

XU - indicates a substance exempt from reporting under the Chemical Data Reporting Rule, (40 CFR 711).

Status: Active Update: 04-08-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/14437

1,2-Ethanediol, diacetate: Does not have an individual approval but may be used under an appropriate group standard

DOT LabelCombustible Liquid
Fire HazardsThis chemical is combustible. (NTP, 1992)
Fire PotentialLOW, WHEN EXPOSED TO HEAT OR FLAME ...
Health HazardsInhalation is not hazardous. Liquid causes mild irritation of eyes. Ingestion causes stupor or coma. (USCG, 1999)
Hazards Summary · 1 Eintrag

Its toxicity in animal experiments is thought to be due to metabolic conversion into ethylene glycol (EG); Animals poisoned with EGD have urinary oxalate crystals, an almost pathognomic sign of EG toxicosis; [EPA ChAMP HPV: Ethylene glycol diacetate - 2002] A mild eye irritant; [HSDB]; Causes general anesthesia in oral lethal-dose studies; Other adverse effects in multiple dose tests were changes in the blood and liver; [RTECS] Caused kidney stone formation and kidney damage in high-dose feeding studies of animals; [CHEMINFO] A mild skin irritant; [MSDSonline] See Ethylene glycol.

Sicherheit und Schutzausrüstung

Fire Fighting · 1 Eintrag

Excerpt from ERG Guide 128 [Flammable Liquids (Water-Immiscible)]:;CAUTION: The majority of these products have a very low flash point. Use of water spray when fighting fire may be inefficient. CAUTION: For mixtures containing alcohol or polar solvent, alcohol-resistant foam may be more effective.;SMALL FIRE: Dry chemical, CO2, water spray or regular foam. If regular foam is ineffective or unavailable, use alcohol-resistant foam.;LARGE FIRE: Water spray, fog or regular foam. If regular foam is ineffective or unavailable, use alcohol-resistant foam. Avoid aiming straight or solid streams directly onto the product. If it can be done safely, move undamaged containers away from the area around the fire.;FIRE INVOLVING TANKS, RAIL TANK CARS OR HIGHWAY TANKS: Fight fire from maximum distance or use unmanned master stream devices or monitor nozzles. Cool containers with flooding quantities of water until well after fire is out. For petroleum crude oil, do not spray water directly into a breached tank car. This can lead to a dangerous boil over. Withdraw immediately in case of rising sound from venting safety devices or discoloration of tank. ALWAYS stay away from tanks in direct contact with flames. For massive fire, use unmanned master stream devices or monitor nozzles; if this is impossible, withdraw from area and let fire burn. (ERG, 2024)

First Aid · 1 Eintrag

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.;SKIN: IMMEDIATELY flood affected skin with water while removing and isolating all contaminated clothing. Gently wash all affected skin areas thoroughly with soap and water. If symptoms such as redness or irritation develop, IMMEDIATELY call a physician and be prepared to transport the victim to a hospital for treatment.;INHALATION: IMMEDIATELY leave the contaminated area; take deep breaths of fresh air. If symptoms (such as wheezing, coughing, shortness of breath, or burning in the mouth, throat, or chest) develop, call a physician and be prepared to transport the victim to a hospital. Provide proper respiratory protection to rescuers entering an unknown atmosphere. Whenever possible, Self-Contained Breathing Apparatus (SCBA) should be used; if not available, use a level of protection greater than or equal to that advised under Protective Clothing.;INGESTION: DO NOT INDUCE VOMITING. If the victim is conscious and not convulsing, give 1 or 2 glasses of water to dilute the chemical and IMMEDIATELY call a hospital or poison control center. Be prepared to transport the victim to a hospital if advised by a physician. If the victim is convulsing or unconscious, do not give anything by mouth, ensure that the victim's airway is open and lay the victim on his/her side with the head lower than the body. DO NOT INDUCE VOMITING. IMMEDIATELY transport the victim to a hospital. (NTP, 1992)

Fire Fighting Procedures · 2 Einträge

WATER, ALCOHOL FOAM, DRY CHEMICAL, OR CARBON DIOXIDE.

If material on fire or involved in fire: Do not extinguish fire unless flow can be stopped or safely confined. Use water in flooding quantities as fog. Solid streams of water may be ineffective. Cool all affected containers with flooding quantities of water. Apply water from as far a distance as possible. Use "alcohol" foam, dry chemical or carbon dioxide.

Storage ConditionsStorage temp: ambient; venting: open (flame arrester)
Nonfire Spill Response · 1 Eintrag

Excerpt from ERG Guide 128 [Flammable Liquids (Water-Immiscible)]:;ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area. All equipment used when handling the product must be grounded. Do not touch or walk through spilled material. Stop leak if you can do it without risk. Prevent entry into waterways, sewers, basements or confined areas. A vapor-suppressing foam may be used to reduce vapors. Absorb or cover with dry earth, sand or other non-combustible material and transfer to containers. Use clean, non-sparking tools to collect absorbed material.;LARGE SPILL: Dike far ahead of liquid spill for later disposal. Water spray may reduce vapor, but may not prevent ignition in closed spaces. (ERG, 2024)

Disposal Methods · 1 Eintrag

SRP: At the time of review, criteria for land treatment or burial (sanitary landfill) disposal practices are subject to significant revision. Prior to implementing land disposal of waste residue (including waste sludge), consult with environmental regulatory agencies for guidance on acceptable disposal practices.

Toxikologische Informationen

Ecotoxicity Values · 2 Einträge

LC50 Lepomis macrochirus (bluegill sunfish) 90 ppm/96 hr, static bioassay in fresh water @ 23 °C: mild aeration applied after 24 hr

LC50 Menidia beryllina (tidewater silverside) 78 ppm/96 hr, static bioassay in synthetic seawater @ 23 °C: mild aeration applied after 24 hr

Environmental Fate · 3 Einträge

TERRESTRIAL FATE: Based on a recommended classification scheme(1), an estimated Koc value of 10(SRC), determined from a structure estimation method(2), indicates that ethylene glycol diacetate should have very high mobility in soil(SRC). Volatilization of ethylene glycol diacetate is not expected to be important from moist soil surfaces(SRC) given an estimated Henry's Law constant of 8.4X10-8 atm-cu m/mole(SRC), calculated from experimental values of vapor pressure(3) and water solubility(4) but may occur from dry soil surfaces(SRC), based on an experimental vapor pressure of 7.74X10-2 mm Hg(3). Ethylene glycol diacetate is expected to biodegrade in soil based on Hach respirometric and OECD Screening (die-away) tests using sewage inocula(4).

AQUATIC FATE: Based on a recommended classification scheme(1), an estimated Koc value of 10(SRC), determined from a structure estimation method(2), indicates that ethylene glycol diacetate would not adsorb to suspended solids and sediment(SRC) in the water. Ethylene glycol diacetate will be essentially non-volatile from water surfaces based on an estimated Henry's Law constant of 8.4X10-8 atm-cu m/mole(SRC), calculated from experimental values for vapor pressure (3) and water solubility(4). An estimated BCF value of 1.2(1,SRC), from an estimated log Kow(5,SRC), suggests that ethylene glycol diacetate will not bioconcentrate in aquatic organisms(SRC), according to a recommended classification scheme(6). The half-lives for the base-catalyzed hydrolysis of ethylene glycol diacetate have been estimated to be 15 days at pH of 8 and 152 days at a pH of 7(7,SRC). Ethylene glycol diacetate is expected to biodegrade in water based on Hach respirometric and OECD Screening (die-away) tests using sewage inocula(8).

ATMOSPHERIC FATE: According to a model of gas/particle partitioning of semivolatile organic compounds in the atmosphere(1), ethylene glycol diacetate, which has an experimental vapor pressure of 7.74X10-2 mm Hg at 25 °C(2), will exist as a vapor in the ambient atmosphere. Vapor-phase ethylene glycol diacetate is degraded in the atmosphere by reaction with photochemically produced hydroxyl radicals(SRC); the half-life for this reaction in air is estimated to be about 4.1 days(3,SRC).

Food Survey ValuesEthylene glycol diacetate has been identified as a volatile component of chicken(1).
Adverse Effects · 1 Eintrag

Neurotoxin - Other CNS neurotoxin;Occupational hepatotoxin - Secondary hepatotoxins: the potential for toxic effect in the occupational setting is based on cases of poisoning by human ingestion or animal experimentation.;Nephrotoxin - The chemical is potentially toxic to the kidneys in the occupational setting.

Effluent ConcentrationsEthylene glycol diacetate was detected as a volatile pollutant in a rubber manufacturing plant (specifically an electrical cables insulation plant - extrusion area) at an observed concentration range of 0-5 ug/cu m(1).
Soil Adsorption/Mobility · 1 Eintrag

Using a structure estimation method based on molecular connectivity indices(1), the Koc for ethylene glycol diacetate can be estimated to be about 10(SRC). According to a recommended classification scheme(2), this estimated Koc value suggests that ethylene glycol diacetate should have very high mobility in soil(SRC).

Regulatorische Informationen

Regulatory Information · 6 Einträge

Chemical: Poly(oxy-1,2-ethanediyl), .alpha.-acetyl-.omega.-(acetyloxy)-

Chemical: 1,2-Ethanediol, diacetate

1,2-Ethanediol, 1,2-diacetate is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,2-Ethanediol, 1,2-diacetate are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

XU - indicates a substance exempt from reporting under the Chemical Data Reporting Rule, (40 CFR 711).

Status: Active Update: 04-08-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/14437

1,2-Ethanediol, diacetate: Does not have an individual approval but may be used under an appropriate group standard

Atmospheric Standards · 1 Eintrag

This action promulgates standards of performance for equipment leaks of Volatile Organic Compounds (VOC) in the Synthetic Organic Chemical Manufacturing Industry (SOCMI). The intended effect of these standards is to require all newly constructed, modified, and reconstructed SOCMI process units to use the best demonstrated system of continuous emission reduction for equipment leaks of VOC, considering costs, non air quality health and environmental impact and energy requirements. Ethylene glycol diacetate is produced, as an intermediate or final product, by process units covered under this subpart.

Sicherheitsdaten

F
3
wgk
1
tsca
TSCA listed
hs_code
29153900
RTECS-Nr.
KW4025000
risk_code
36/37/38

Chemie und Industrie

Pharmakologische Informationen

Metabolism/MetabolitesTHEY /ETHYLENE GLYCOL ALKYL (& ARYL) ESTERS/ ARE READILY SAPONIFIED IN THE BODY TO GLYCOL & THE CORRESPONDING ORGANIC ACID.

Verwendung und Herstellung

Uses · 6 Einträge

Used as solvent for oils, explosives, cellulose esters, cellulose ethers, natural products, printing inks, perfume fixatives, resins, and lacquers; Also used as a non-discoloring plasticizer for ethyl and benzyl cellulose; [HSDB] Used mainly as a re-flow solvent in thermoplastic acrylic coatings and in foundries (slow-release source of acetic acid for making cores); Also used as an ink solvent; [EPA ChAMP HPV: Ethylene glycol diacetate - 2002]

Molding and Core Making [Category: Foundry];Painting (Solvents) [Category: Paint]

SOLVENT FOR OILS AND EXPLOSIVES

SOLVENT FOR WIDE RANGE OF CELLULOSE ESTERS, CELLULOSE ETHERS, NATURAL PRODUCTS, PRINTING INKS & PERFUME FIXATIVES

RESINS; LACQUERS; NON-DISCOLORING PLASTICIZER FOR ETHYL & BENZYL CELLULOSE

SOLVENT FOR CELLULOSE ACETATE & NITRATE, ETHYL CELLULOSE, MASTIC, COLOPHONY & GUM CAMPHOR, BUT NOT FOR ESTER GUM, HARD COPAL OR CUMARONE.

U.S. Production · 3 Einträge

2023: 1,000,000 - <2,500,000 lb;2022: 1,000,000 - <2,500,000 lb;2021: 1,000,000 - <2,500,000 lb;2020: 1,000,000 - <2,500,000 lb

(1972) 2.43X10+9 G (SALES)

(1975) PROBABLY GREATER THAN 9.08X10+5 G

Consumer UsesNot Known or Reasonably Ascertainable
Industry UsesSolvent
Methods of Manufacturing · 4 Einträge

REACTION OF ETHYLENE GLYCOL AND ACETIC ACID IN THE PRESENCE OF A MINERAL ACID.

PREPARED FROM ETHYLENE BROMIDE, GLACIAL ACETIC ACID & POTASSIUM ACETATE.

BY HEATING ETHYLENE DICHLORIDE WITH POTASSIUM OR SODIUM ACETATE IN PRESENCE OF ABOUT 5% OF ETHYLENE GLYCOL UNDER PRESSURE.

... Ethylene oxidation catalyzed by tellurium dioxide and hydrobromic acid in acetic acid gives the glycol diacetate ...

Formulations/PreparationsGRADES OR PURITY: 98+%
Anwendungen · 1 Eintrag

VerwendenEthylene glycol diacetate may be used as an acyl donor for the in situ generation of peracetic acid, during the chemoenzymatic synthesis of caprolactone. It may be employed as a precursor for the enzymatic synthesis of poly (ethylene glutarate).

Vor- und nachgelagerte Produkte

Anbieter50 Anbieter

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
南通润丰石油化工有限公司66017690 19952660367 · [email protected]

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