ISOAMYL PALMITATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H42O2
Molecular Weight	326.557
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ISOAMYL PALMITATE

Structure Search

SMILES

CCCCCCCCCCCCCCCC(=O)OCCC(C)C

InChI

InChIKey=NXBIDOXPIIWDMX-UHFFFAOYSA-N

InChI=1S/C21H42O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(22)23-19-18-20(2)3/h20H,4-19H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C21H42O2
Molecular Weight	326.557
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:04:55 GMT 2025` Edited by `admin` on `Mon Mar 31 23:04:55 GMT 2025`
Record UNII	464H5ENW74
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

ISOAMYL PALMITATE

Systematic Name

English

3-METHYLBUTYL HEXADECANOATE

Preferred Name

English

HEXADECANOIC ACID, 3-METHYLBUTYL ESTER

Systematic Name

English

ISOPENTYL HEXADECANOATE

Systematic Name

English

Code System Code Type Description

PUBCHEM

3019031

Created by admin on Mon Mar 31 23:04:55 GMT 2025 , Edited by admin on Mon Mar 31 23:04:55 GMT 2025

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CAS

81974-61-0

Created by admin on Mon Mar 31 23:04:55 GMT 2025 , Edited by admin on Mon Mar 31 23:04:55 GMT 2025

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ECHA (EC/EINECS)

279-864-8

Created by admin on Mon Mar 31 23:04:55 GMT 2025 , Edited by admin on Mon Mar 31 23:04:55 GMT 2025

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FDA UNII

464H5ENW74

Created by admin on Mon Mar 31 23:04:55 GMT 2025 , Edited by admin on Mon Mar 31 23:04:55 GMT 2025

PRIMARY

EPA CompTox

DTXSID70868634

Created by admin on Mon Mar 31 23:04:55 GMT 2025 , Edited by admin on Mon Mar 31 23:04:55 GMT 2025

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