Dihexyl Adipate

HCID 8046CAS 110-33-8
TeilstruktursucheÄhnliche Strukturen suchen

Grundinformationen

Standard-SMILES
CCCCCCOC(=O)CCCCC(=O)OCCCCCC
InChIKey
HHECSPXBQJHZAF-UHFFFAOYSA-N
Summenformel
C18H34O4
Durchschnittliche Molmasse
314,5 g/mol
Monoisotopische Masse
314,24570956

Namen und Bezeichner

Bevorzugter Name
Dihexyl Adipate
IUPAC
dihexyl hexanedioate
Lokaler Name
Dihexyladipat
Englischer Name
Hexanedioic acid dihexyl ester
Summenformel
C18H34O4
Molmasse
314.46

Namen und Synonyme

DIHEXYL ADIPATE110-33-8Dihexyl hexanedioateHexanedioic acid, dihexyl esterDi-n-hexyl adipateAdipic acid, dihexyl esterPlasticizer dihexyl adipateDTXSID9026841EINECS 203-757-7H16ECG10GBBRN 1798668PLASTOMOLL DHA
Weitere Namen anzeigen
DHAihexylhexanedioateHexanedioic acid dihhexyldiacidihexyl esterHexanedioic acid dihexyl esterDihydroartemisinin (β-Dihydroartemisinin
AI3-07963Hexanedioic acid, 1,6-dihexyl esterDTXCID806841EC 203-757-7203-757-7RefChem:587637DIHEXYL ADIPATE [INCI]Hexanedioic acid,1,6-dihexyl ester

Datenbank-Bezeichner

CAS
110-33-8
PubChem CID
8046
DTXSID
DTXSID9026841
ChEMBL
CHEMBL3185271
UNII
H16ECG10GB
EC Number
203-757-7
Nikkaji
J45.541E

Eigenschaften

Berechnete Struktureigenschaften

XLogP
5,3
Polarare Oberfläche (TPSA)
52,6 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
4
Frei drehbare Bindungen
17
Schwere Atome
22

Experimentelle und physikochemische Eigenschaften

Density0.939 at 68 °F (USCG, 1999) - Less dense than water; will float
Flash Point325 °F (USCG, 1999)
Physical DescriptionDi-n-hexyl adipate is a colorless liquid. Floats on water. (USCG, 1999)
Kovats Retention Index2140；2113
Collision Cross Section202.5 Ų [M+Na]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID9026841]

Physikochemische Eigenschaften

Schmelzpunkt
-13.8 °C · -13.8°C
Siedepunkt
374.13 °C · 374.13°C (rough estimate)
Dichte
0.932 · 0.9320
Dampfdruck
0 Pa · 0Pa at 25℃
Brechungsindex
1.4397 · 1.4397 (estimate)
Wasserlöslichkeit
2.6 mg/L · 2.6mg/L at 20℃

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 3 Einträge

This chemical does not meet GHS hazard criteria for 100% (17 of 17) of all reports.

Not Classified；Reported as not meeting GHS hazard criteria by 17 of 17 companies. For more detailed information, please visit ECHA C&L website.

Aggregated GHS information provided per 17 reports by companies from 1 notifications to the ECHA C&L Inventory.；Reported as not meeting GHS hazard criteria per 17 of 17 reports by companies.；There are 0 notifications provided by 0 of 17 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 · 4 Einträge

Chemical: Hexanedioic acid, dihexyl ester

Hexanedioic acid, 1,6-dihexyl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Hexanedioic acid, 1,6-dihexyl ester 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)

Status: Active Update: 23-09-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/12571

Hexanedioic acid, dihexyl ester: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Other Safety InformationEvaluation - Chemicals that are unlikely to require further regulation to manage risks to human health
Fire HazardsSpecial Hazards of Combustion Products: Irritating vapors and toxic gases, such as carbon dioxide and carbon monoxide, may be formed when involved in fire. (USCG, 1999)
Health HazardsExposure can cause irritation of eyes, nose and throat. (USCG, 1999)
Reactive GroupEsters, Sulfate Esters, Phosphate Esters, Thiophosphate Esters, and Borate Esters
Reactivity Profile · 1 Eintrag

DI-N-HEXYL ADIPATE is an ester. Esters react with acids to liberate heat along with alcohols and acids. Strong oxidizing acids may cause a vigorous reaction that is sufficiently exothermic to ignite the reaction products. Heat is also generated by the interaction of esters with caustic solutions. Flammable hydrogen is generated by mixing esters with alkali metals and hydrides.

Sicherheit und Schutzausrüstung

Fire FightingFire Extinguishing Agents Not to Be Used: Water.；Fire Extinguishing Agents: Dry chemical, alcohol foam, or carbon dioxide. (USCG, 1999)
First Aid · 1 Eintrag

Get medical attention.；INHALATION: Remove to fresh air. If breathing has stopped, give artificial respiration. If breathing is difficult, give oxygen.；EYES: Flush with water for at least 15 min., lifting lids occasionally.；SKIN: Remove contaminated clothing and shoes. Wash with soap and water. (USCG, 1999)

Personal Protective Equipment (PPE)Full impervious protective clothing, including boots and gloves. Where splashing is possible wear full face shield or chemical safety goggles. Use approved respirator to protect against vapors. (USCG, 1999)

Toxikologische Informationen

Toxicity SummarySafe in the present practices of use and concentration. Ingredient, concentration, and use information are available in documents discoverable at https://cir-reports.cir-safety.org

Regulatorische Informationen

Regulatory Information · 4 Einträge

Chemical: Hexanedioic acid, dihexyl ester

Hexanedioic acid, 1,6-dihexyl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Hexanedioic acid, 1,6-dihexyl ester 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)

Status: Active Update: 23-09-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/12571

Hexanedioic acid, dihexyl ester: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Sicherheitsdaten

wgk
WGK 1
tsca
TSCA listed
Speicherklasse
13 - Non Combustible Solids

Chemie und Industrie

Verwendung und Herstellung

Uses · 2 Einträge

CIR ingredient: Dihexyl Adipate

Plastics -> Typical concentration range in plastic materials -> 10.0 - 35.0%

U.S. Production2023: <50,000 lb；2022: <50,000 lb；2021: <50,000 lb；2020: 50,000 - <250,000 lb
Use Classification · 3 Einträge

Cosmetics -> Emollient

Plastics -> Polymer Type -> PUR; PVC (soft)

Plastics -> Plasticisers

General Manufacturing InformationHexanedioic acid, 1,6-dihexyl ester: ACTIVE

Anbieter50 Anbieter

Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
湖北兴琰新材料科技有限公司13129948835 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]

Zugehörige Reaktionen

1
Reaktionsaufzeichnung erstellen

Verknüpfte Notizen

Wird geladen…