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HCID 8046Erstellt: 25. Oktober 2026

Dihexyladipat

DHA · dihexyl adipate · ihexylhexanedioate · Hexanedioic acid dih · hexyldiacidihexyl ester · Hexanedioic acid dihexyl ester · Hexanedioic acid,1,6-dihexyl ester · Dihydroartemisinin (β-Dihydroartemisinin

https://huagongshe.com/de/chemical/8046

Molekülstruktur von Dihexyladipat

Identifikatoren & physikalische Daten

CAS No.110-33-8
SummenformelC18H34O4
Durchschnittliche Molmasse314,5 g/mol
Monoisotopische Masse314,24570956 g/mol
SMILESCCCCCCOC(=O)CCCCC(=O)OCCCCCC
InChIKeyHHECSPXBQJHZAF-UHFFFAOYSA-N
PubChem CID8046
ChEMBLCHEMBL3185271
EC No.203-757-7
DTXSIDDTXSID9026841
Lokaler NameDihexyladipat

Chemische & physikalische Eigenschaften

XLogP5,3
Polarare Oberfläche (TPSA)52,6
H-Brücken-Donoren0
H-Brücken-Akzeptoren4
Frei drehbare Bindungen17
Schwere Atome22
Formalladung0
Komplexität248
Dichte0.939 at 68 °F (USCG, 1999) - Less dense than waterwill float0.9320
Flammpunkt325 °F (USCG, 1999)
Physical DescriptionDi-n-hexyl adipate is a colorless liquid. Floats on water. (USCG, 1999)
Kovats Retention Index21402113
Collision Cross Section202.5 Ų [M+Na]+ [CCS Type: DTBuffer gas: N2Ionization: ESI+Dataset: TOXCASTSource Identifier: DTXSID9026841]
Schmelzpunkt-13.8°C
Siedepunkt374.13°C (rough estimate)
Dampfdruck0Pa at 25℃
Brechungsindex1.4397 (estimate)
Löslichkeit2.6mg/L at 20℃
Kosmetik-Inhaltsstoffe FunktionenSKIN CONDITIONINGSKIN CONDITIONING - EMOLLIENTSOLVENT
InChI1S/C18H34O4/c1-3-5-7-11-15-21-17(19)13-9-10-14-18(20)22-16-12-8-6-4-2/h3-16H2,1-2H3
InChIKeyHHECSPXBQJHZAF-UHFFFAOYSA-N
SMILESCCCCCCOC(=O)CCCCC(=O)OCCCCCC
LogP (Verteilungskoeffizient)6.2 at 20℃
NIST chemische InformationenHexanedioic acid, dihexyl ester(110-33-8)
EPA chemische InformationenDihexyl adipate (110-33-8)

Sicherheit & Vorschriften

GHS-EinstufungThis chemical does not meet GHS hazard criteria for 100% (17 of 17) of all reports.Not ClassifiedReported 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.
Regulatorische InformationenChemical: Hexanedioic acid, dihexyl esterHexanedioic 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/12571Hexanedioic 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.
Weitere SicherheitsinformationenEvaluation - Chemicals that are unlikely to require further regulation to manage risks to human health
BrandgefahrenSpecial 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)
GesundheitsgefahrenExposure can cause irritation of eyes, nose and throat. (USCG, 1999)
Reaktive GruppeEsters, Sulfate Esters, Phosphate Esters, Thiophosphate Esters, and Borate Esters
Reactivity ProfileDI-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.
Air and Water ReactionsNo rapid reaction with air. No rapid reaction with water.
Hazard Classes and CategoriesNot Classified
BrandbekämpfungFire Extinguishing Agents Not to Be Used: Water.Fire Extinguishing Agents: Dry chemical, alcohol foam, or carbon dioxide. (USCG, 1999)
Erste HilfeGet 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)
ToxizitätsübersichtSafe 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
Wassergefährdungsklasse (WGK)WGK 1
TSCA-Inventar-StatusTSCA listed
Lagerklasse13 - Non Combustible Solids