Phenylchlorformiat

Phenyl chloroformate

HCID 15891CAS 1885-14-9

Grundinformationen

Standard-SMILES
O=C(Cl)Oc1ccccc1
InChIKey
AHWALFGBDFAJAI-UHFFFAOYSA-N
Summenformel
C7H5ClO2
Durchschnittliche Molmasse
156,56 g/mol
Monoisotopische Masse
155,9978071

Namen und Bezeichner

Bevorzugter Name
Phenyl chloroformate
IUPAC
phenyl carbonochloridate
Lokaler Name
Phenylchlorformiat
Englischer Name
Phenyl chloroformate
Summenformel
C7H5ClO2
Molmasse
156.57

Namen und Synonyme

PHENYL CHLOROFORMATE1885-14-9phenyl carbonochloridatePhenyl chlorocarbonateChloroformic acid phenyl esterCarbonochloridic acid, phenyl esterPhenoxycarbonyl chloridePHENYLCHLOROFORMATEFormic acid, chloro-, phenyl esterFenylester kyseliny chlormravenciDTXSID90444036TND0D6D3Y
Weitere Namen anzeigen
CARBONOCHLORIDIC ACIDchlorocarbonic acidPHENYL CHLOROFORMATPhenyl choroformatecarbonochloridic acid phenyl esterPHENYL CHLOROFORMATE / CHLOROFORMIC ACID PHENYL ESTERtl398
TL 398phenyloxycarbonyl chlorideNSC-210946PHENYLCHLOROFORMIC ACIDDTXCID7024403RefChem:172952217-547-8MFCD00000637

Datenbank-Bezeichner

CAS
1885-14-9
PubChem CID
15891
DTXSID
DTXSID9044403
UNII
6TND0D6D3Y
EC Number
217-547-8
Nikkaji
J33.963F

Eigenschaften

Berechnete Struktureigenschaften

XLogP
2,6
Polarare Oberfläche (TPSA)
26,3 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
2
Frei drehbare Bindungen
2
Schwere Atome
10

Experimentelle und physikochemische Eigenschaften

Density · 3 Einträge

Density (at 20 °C): 1.2 g/cm³

Relative density of the vapour/air-mixture at 20 °C (air = 1): 1.00

1.244 @25 °C

SolubilitySolubility in water: reaction
Flash Point69 °C c.c.
Boiling Point188-189 °C
Melting Point-28 °C
Vapor DensityRelative vapor density (air = 1): 5.41

Physikochemische Eigenschaften

Schmelzpunkt
-28 °C · -28 °C
Siedepunkt
74 · 74-75 °C/13 mmHg (lit.)
Dichte
1.248 g/mL · 1.248 g/mL at 25 °C (lit.)
Dampfdichte
1 · 1 (vs air)
Dampfdruck
1.22 psi · 1.22 psi ( 20 °C)
Brechungsindex
20 · n20/D 1.511(lit.)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

Danger

H290 (60.1%): May be corrosive to metals [Warning Corrosive to Metals];H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral];H314 (93.1%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation];H317 (10.6%): May cause an allergic skin reaction [Warning Sensitization, Skin];H318 (31.9%): Causes serious eye damage [Danger Serious eye damage/eye irritation];H330 (96.8%): Fatal if inhaled [Danger Acute toxicity, inhalation];H335 (67%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation];H412 (23.4%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

P234, P260, P261, P264, P264+P265, P270, P271, P272, P273, P280, P284, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P320, P321, P330, P333+P317, P362+P364, P363, P390, P403+P233, P405, P406, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 188 reports by companies from 18 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;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 · 4 Einträge

Chemical: Carbonochloridic acid, phenyl ester

Status: Active Update: 08-07-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/5352

Phenyl chloroformate: Does not have an individual approval but may be used under an appropriate group standard

The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)

Other Safety InformationEvaluation - Chemicals that are unlikely to require further regulation to manage risks to human health
DOT LabelPoison Corrosive
Fire Hazards · 3 Einträge

Excerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:;Combustible material: may burn but does not ignite readily. Substance will react with water (some violently) releasing flammable, toxic or corrosive gases and runoff. When heated, vapors may form explosive mixtures with air: indoors, outdoors and sewers explosion hazards. Most vapors are heavier than air. They will spread along the ground and collect in low or confined areas (sewers, basements, tanks, etc.). Vapors may travel to source of ignition and flash back. Corrosives in contact with metals may evolve flammable hydrogen gas. Containers may explode when heated or if contaminated with water. (ERG, 2024)

· Combustible material: may burn but does not ignite readily.;· Substance will react with water (some violently) releasing flammable, toxic or corrosive gases and runoff.;· When heated, vapors may form explosive mixtures with air: indoors, outdoors and sewers explosion hazards.;· Most vapors are heavier than air. They will spread along the ground and collect in low or confined areas (sewers, basements, tanks, etc.).;· Vapors may travel to source of ignition and flash back.;· Corrosives in contact with metals may evolve flammable hydrogen gas.;· Containers may explode when heated or if contaminated with water.

Combustible. Gives off irritating or toxic fumes (or gases) in a fire. Above 69 °C explosive vapour/air mixtures may be formed.

Health Hazards · 2 Einträge

Excerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:;TOXIC and/or CORROSIVE; inhalation, ingestion or contact (skin, eyes) with vapors, dusts or substance may cause severe injury, burns or death. Contact with molten substance may cause severe burns to skin and eyes. Reaction with water or moist air may release toxic, corrosive or flammable gases. Reaction with water may generate much heat that will increase the concentration of fumes in the air. Fire will produce irritating, corrosive and/or toxic gases. Runoff from fire control or dilution water may be corrosive and/or toxic and cause environmental contamination. (ERG, 2024)

· TOXIC and/or CORROSIVE; inhalation, ingestion or contact (skin, eyes) with vapors, dusts or substance may cause severe injury, burns or death.;· Contact with molten substance may cause severe burns to skin and eyes.;· Reaction with water or moist air may release toxic, corrosive or flammable gases.;· Reaction with water may generate much heat that will increase the concentration of fumes in the air.;· Fire will produce irritating, corrosive and/or toxic gases.;· Runoff from fire control or dilution water may be corrosive and/or toxic and cause environmental contamination.

Hazards Summary · 1 Eintrag

Decomposed by water producing hydrogen chloride and phenol; A corrosive substance that can cause injury to the skin, eyes, and respiratory tract; Inhalation may cause pulmonary edema; [ICSC] Reacts with water evolving hydrogen chloride; Fumes in moist air releasing hydrogen chloride; A strong skin and eye irritant; [CAMEO] A skin irritant; Corrosive to eyes; [eChemPortal: ERMA] Reacts with water; A corrosive substance that can cause injury to the skin, eyes, and respiratory tract; Inhalation may cause chemical pneumonitis; [MSDSonline] See CHLOROFORMATES.

Sicherheit und Schutzausrüstung

Fire Fighting · 2 Einträge

Excerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:;Note: Most foams will react with the material and release corrosive/toxic gases. CAUTION: For Acetyl bromide (UN1716), use CO2 or dry chemical only.;SMALL FIRE: CO2, dry chemical, dry sand, alcohol-resistant foam.;LARGE FIRE: Water spray, fog or alcohol-resistant foam. FOR CHLOROSILANES, DO NOT USE WATER; use alcohol-resistant foam. If it can be done safely, move undamaged containers away from the area around the fire. Avoid aiming straight or solid streams directly onto the product.;FIRE INVOLVING TANKS, RAIL TANK CARS OR HIGHWAY TANKS: Fight fire from maximum distance or use unmanned master stream devices or monitor nozzles. Do not get water inside containers. Cool containers with flooding quantities of water until well after fire is out. 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. (ERG, 2024)

NO water. Use dry powder, carbon dioxide, alcohol-resistant foam.

First Aid Measures · 4 Einträge

Fresh air, rest. Half-upright position. Artificial respiration may be needed. Refer immediately for medical attention.

Remove contaminated clothes. Rinse skin with plenty of water or shower. Refer immediately for medical attention.

Rinse with plenty of water for several minutes (remove contact lenses if easily possible). Refer immediately for medical attention.

Rinse mouth. Do NOT induce vomiting. Give one or two glasses of water to drink. Refer immediately for medical attention.

Accidental Release Measures · 2 Einträge

· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.;· Keep unauthorized personnel away.;· Stay upwind, uphill and/or upstream.;· Ventilate closed spaces before entering, but only if properly trained and equipped.

· 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 damaged containers or spilled material unless wearing appropriate protective clothing.;· Stop leak if you can do it without risk.;· A vapor-suppressing foam may be used to reduce vapors.;· FOR CHLOROSILANES, use alcohol-resistant foam to reduce vapors.;· DO NOT GET WATER on spilled substance or inside containers.;· Use water spray to reduce vapors or divert vapor cloud drift. Avoid allowing water runoff to contact spilled material.;· Prevent entry into waterways, sewers, basements or confined areas.;Small Spill;· Cover with DRY earth, DRY sand or other non-combustible material followed with plastic sheet to minimize spreading or contact with rain.;· Use clean, non-sparking tools to collect material and place it into loosely covered plastic containers for later disposal.

First Aid · 2 Einträge

Excerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:;Refer to the "General First Aid" section. Specific First Aid: For corrosives, in case of contact, immediately flush skin or eyes with running water for at least 30 minutes. Additional flushing may be required. Removal of solidified molten material from skin requires medical assistance. (ERG, 2024)

General First Aid:;· Call 911 or emergency medical service.;· Ensure that medical personnel are aware of the material(s) involved, take precautions to protect themselves and avoid contamination.;· Move victim to fresh air if it can be done safely.;· Administer oxygen if breathing is difficult.;· If victim is not breathing:;-- DO NOT perform mouth-to-mouth resuscitation; the victim may have ingested or inhaled the substance.;-- If equipped and pulse detected, wash face and mouth, then give artificial respiration using a proper respiratory medical device (bag-valve mask, pocket mask equipped with a one-way valve or other device).;-- If no pulse detected or no respiratory medical device available, provide continuous compressions. Conduct a pulse check every two minutes or monitor for any signs of spontaneous respirations.;· Remove and isolate contaminated clothing and shoes.;· For minor skin contact, avoid spreading material on unaffected skin.;· In case of contact with substance, remove immediately by flushing skin or eyes with running water for at least 20 minutes.;· For severe burns, immediate medical attention is required.;· Effects of exposure (inhalation, ingestion, or skin contact) to substance may be delayed.;· Keep victim calm and warm.;· Keep victim under observation.;· For further assistance, contact your local Poison Control Center.;· Note: Basic Life Support (BLS) and Advanced Life Support (ALS) should be done by trained professionals.;Specific First Aid:;· For corrosives, in case of contact, immediately flush skin or eyes with running water for at least 30 minutes. Additional flushing may be required.

Safe StorageDry. Well closed. Ventilation along the floor. Separated from acids, alcohols, amines, bases, oxidants and food and feedstuffs. Store in an area without drain or sewer access.
Exposure Control and Personal Protection · 1 Eintrag

· Wear positive pressure self-contained breathing apparatus (SCBA).;· Wear chemical protective clothing that is specifically recommended by the manufacturer when there is NO RISK OF FIRE.;· Structural firefighters' protective clothing provides thermal protection but only limited chemical protection.

Toxikologische Informationen

Adverse EffectsDermatotoxin - Skin burns.;Toxic Pneumonitis - Inflammation of the lungs induced by inhalation of metal fumes or toxic gases and vapors.
Exposure RoutesThe substance can be absorbed into the body by inhalation of its vapour and by ingestion. Serious local effects on contact with eyes and skin.
Signs and Symptoms · 4 Einträge

Sore throat. Burning sensation. Cough. Laboured breathing. Shortness of breath. Symptoms may be delayed.

Redness. Pain. Skin burns.

Redness. Pain. Severe burns.

Burning sensation in the mouth and in the throat and chest. Sore throat. Abdominal pain. Diarrhoea. Shock or collapse.

ICSC Environmental DataThe substance is harmful to aquatic organisms.
Toxicity DataLCLo (rat) = 44 ppm/4h

Regulatorische Informationen

Regulatory Information · 4 Einträge

Chemical: Carbonochloridic acid, phenyl ester

Status: Active Update: 08-07-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/5352

Phenyl chloroformate: Does not have an individual approval but may be used under an appropriate group standard

The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)

Sicherheitsdaten

F
10-19-21
wgk
3
tsca
TSCA listed
ridadr
UN 2746
hs_code
29159020
RTECS-Nr.
FG3850000

Chemie und Industrie

Verwendung und Herstellung

UsesUsed to make other chemicals; [CAMEO]
General Manufacturing InformationCarbonochloridic acid, phenyl ester: ACTIVE
Anwendungen · 1 Eintrag

VerwendenPhenyl chloroformate is used in the synthesis of poly(2-(phenoxycarbonyloxy)ethyl methacrylate) and phenyl-(4-vinylphenyl) carbonate. It acts as a precursor of phenyl mixed anhydrides which are used in peptide coupling reactions. It serves as a dehydrating reagent for the conversion of primary amides to nitriles and an intermediate in the synthesis of pharmaceuticals and carbamates.

Darstellung · 1 Eintrag

synthetischePhenyl chloroformate is synthesized by the reaction of phenol with phosgene. Phenol was dissolved in chloroform, phosgene was introduced under cooling, and the absorbed phosgene was in an equal molar ratio to phenol, and equimolar N,N-dimethylaniline was added dropwise under stirring at 5-10 °C. Then add cold water to dilute, separate the oil layer, wash with dilute hydrochloric acid and water successively. After drying with anhydrous calcium chloride, chloroform is evaporated, and then distilled under reduced pressure to collect 74-75°C (1.73kPa) fraction, which is phenyl chloroformate. The yield is about 90%.

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]
邹平铭远进出口贸易有限公司18364991597
河北创海生物科技有限公司+86-86-13131129325 · [email protected]

Zugehörige Reaktionen

2.465

Verknüpfte Notizen

Wird geladen…