Isotridecyl-3,5,5-trimethylhexanoat

Hexanoic acid, 3,5,5-trimethyl-, isotridecyl ester

HCID 100993CAS 42131-27-1

Grundinformationen

Standard-SMILES
CC(C)CCCCCCCCCCOC(=O)CC(C)CC(C)(C)C
InChIKey
WAYINTBTZWQNSN-UHFFFAOYSA-N
Summenformel
C22H44O2
Durchschnittliche Molmasse
340,6 g/mol
Monoisotopische Masse
340,33413064

Namen und Bezeichner

Bevorzugter Name
Hexanoic acid, 3,5,5-trimethyl-, isotridecyl ester
IUPAC
11-methyldodecyl 3,5,5-trimethylhexanoate
Lokaler Name
Isotridecyl-3,5,5-trimethylhexanoat
Englischer Name
isotridecyl 3,5,5-trimethylhexanoate
Summenformel
C22H44O2
Molmasse
340.58356

Namen und Synonyme

59231-37-7Isotridecyl 3,5,5-trimethylhexanoateWickenol 153EINECS 261-675-7Hexanoic acid, 3,5,5-trimethyl-, isotridecyl esterDTXSID70866751Isomeric tetramethyl-1-nonyl 3,5,5-trimethyl hexanoateRefChem:787366DTXCID70815007261-675-711-methyldodecyl 3,5,5-trimethylhexanoateSCHEMBL8575386
Weitere Namen anzeigen
DTXSID00275958DB-308151NS000138023,5,5-trimethylhexanoic acid-isotridecyl esterQ27292590

Datenbank-Bezeichner

CAS
42131-27-1、59231-37-7、60892-53-7
PubChem CID
100993
UNII
WEF51750MT
EC Number
261-675-7
Nikkaji
J3.586.479B

Eigenschaften

Berechnete Struktureigenschaften

XLogP
8,9
Polarare Oberfläche (TPSA)
26,3 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
2
Frei drehbare Bindungen
16
Schwere Atome
24

Physikochemische Eigenschaften

Siedepunkt
161 ℃[at · 161℃[at 101 325 Pa]
Dichte
0.86 · 0.86[at 20℃]
Dampfdruck
0.001 Pa · 0.001Pa at 20℃
Geruch (Odor)
100 % · at 100.00%. bland
Wasserlöslichkeit
250 ng/L · 250ng/L at 25℃
Kosmetik-Inhaltsstoffe Funktionen
SKIN CONDITIONING - EMOLLIENTSKIN CONDITIONING

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 3 Einträge

This chemical does not meet GHS hazard criteria for 100% (24 of 24) of all reports.

Not Classified;Reported as not meeting GHS hazard criteria by 24 of 24 companies. For more detailed information, please visit ECHA C&L website.

Aggregated GHS information provided per 24 reports by companies from 1 notifications to the ECHA C&L Inventory.;Reported as not meeting GHS hazard criteria per 24 of 24 reports by companies.;There are 0 notifications provided by 0 of 24 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 · 3 Einträge

Chemical: Hexanoic acid, 3,5,5-trimethyl-, isotridecyl ester

Status: Active Update: 23-07-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/26650

Hexanoic acid, 3,5,5-trimethyl-, isotridecyl 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.

Hazard Classes and CategoriesNot Classified

Regulatorische Informationen

Regulatory Information · 3 Einträge

Chemical: Hexanoic acid, 3,5,5-trimethyl-, isotridecyl ester

Status: Active Update: 23-07-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/26650

Hexanoic acid, 3,5,5-trimethyl-, isotridecyl 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

tsca
TSCA listed

Chemie und Industrie

Verwendung und Herstellung

Use ClassificationCosmetics -> Emollient; Skin conditioning
General Manufacturing InformationHexanoic acid, 3,5,5-trimethyl-, isotridecyl ester: ACTIVE

Anbieter9 Anbieter

北京华美互利生物化工010-56205725 · [email protected]
湖北兴琰新材料科技有限公司13129948835 · [email protected]
武汉贝乐叶生物医药科技有限公司15871353653 18086118076 · [email protected]
湖北楚盛威化工有限公司87891008 18971625309 · [email protected]
Henan Alfa Chemical Co., Ltd+8618339805032 · [email protected]

Zugehörige Reaktionen

2

Verknüpfte Notizen

Wird geladen…