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Stearyl laurate

HCID 76712
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Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
3234-84-2
Standard SMILES
CCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCC
InChIKey
TZXYSEYEGNHPQI-UHFFFAOYSA-N
Molecular formula
C30H60O2
Average molar mass
452.8 g/mol
Monoisotopic mass
452.45933115

Overview

Octadecyl dodecanoate has been reported in Triticum aestivum with data available.

Names & identifiers

Preferred name
Stearyl laurate
IUPAC
octadecyl dodecanoate
English name
octadecyl laurate
Molecular formula
C30H60O2
Molecular weight
452.8

Names & synonyms

Octadecyl laurateStearyl laurateDodecanoic acid, octadecyl esteroctadecanyl dodecanoateEINECS 221-786-3WE(18:0/12:0)RefChem:889175221-786-3Octadecyl dodecanoate3234-84-2Lauric acid, octadecyl estern-octadecyl dodecanoate
Show more names
Lauric acid octadecyl esterSTEARYL LAURATEStearyl Laurate (C12:0-C18:0)
WE(18:0/12:0); octadecyl dodecanoateOctadecyldodecanoateUZD92JW99ESCHEMBL276745DTXSID4052005LMFA07010039MFCD00079415AKOS028108512

Database identifiers

CAS
3234-84-2
PubChem CID
76712
DTXSID
DTXSID4052005
UNII
UZD92JW99E
EC Number
221-786-3
Nikkaji
J111.068C

Properties

Computed structural propertiesFilling in

XLogP
14.1
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
28
Heavy atoms
32
Formal charge
0
Complexity
353

Experimental & physicochemical properties

LipidsFatty Acyls [FA] -> Fatty esters [FA07] -> Wax monoesters [FA0701]

Physicochemical properties

EPA Substance Registry System
Dodecanoic acid, octadecyl ester (3234-84-2)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 3 items

This chemical does not meet GHS hazard criteria for 100% (8 of 8) of all reports.

Not Classified

Aggregated GHS information provided per 8 reports by companies from 1 notifications to the ECHA C&L Inventory.

Hazard information

Regulatory Information · 2 items

Chemical: Dodecanoic acid, octadecyl ester

Dodecanoic acid, octadecyl ester: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationIMAP assessments - Dodecanoic acid, octadecyl ester: Human health tier I assessment
Hazard Classes and CategoriesNot Classified

Safety data

tsca
TSCA listed
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P280-P301+P312-P302+P352-P305+P351+P338

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationDodecanoic acid, octadecyl ester: ACTIVE

Applications

UsesStearyl laurate is an ester product.

Related reactions

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Compound notes

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