U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C10H20O2
Molecular Weight 172.2646
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISOAMYL 2-METHYLBUTYRATE

SMILES

CCC(C)C(=O)OCCC(C)C

InChI

InChIKey=VGIRHYHLQKDEPP-UHFFFAOYSA-N
InChI=1S/C10H20O2/c1-5-9(4)10(11)12-7-6-8(2)3/h8-9H,5-7H2,1-4H3

HIDE SMILES / InChI

Approval Year

Name Type Language
ISOAMYL 2-METHYLBUTYRATE
Systematic Name English
BUTANOIC ACID, 2-METHYL-, 3-METHYLBUTYL ESTER
Common Name English
ISOAMYL 2-METHYLBUTYRATE, (±)-
Systematic Name English
(±)-ISOAMYL 2-METHYLBUTYRATE
Systematic Name English
ISOPENTYL 2-METHYLBUTANOATE
Systematic Name English
ISOAMYL 2-METHYLBUTANOATE
Systematic Name English
FEMA NO. 3505
Code English
ISOPENTYL 2-METHYLBUTYRATE
Systematic Name English
ISOPENTYL-2-METHYLBUTYRATE
Systematic Name English
3-METHYLBUTYL 2-METHYLBUTYRATE
Systematic Name English
ISOAMYL-2-METHYLBUTYRATE
Systematic Name English
3-METHYLBUTYL 2-METHYLBUTANOATE
FHFI  
Systematic Name English
3-METHYLBUTYL 2-METHYLBUTANOATE [FHFI]
Common Name English
Classification Tree Code System Code
JECFA EVALUATION ISOAMYL 2-METHYLBUTYRATE
Created by admin on Fri Dec 15 19:43:30 GMT 2023 , Edited by admin on Fri Dec 15 19:43:30 GMT 2023
CFR 21 CFR 172.515
Created by admin on Fri Dec 15 19:43:30 GMT 2023 , Edited by admin on Fri Dec 15 19:43:30 GMT 2023
Code System Code Type Description
JECFA MONOGRAPH
624
Created by admin on Fri Dec 15 19:43:30 GMT 2023 , Edited by admin on Fri Dec 15 19:43:30 GMT 2023
PRIMARY
ECHA (EC/EINECS)
248-581-1
Created by admin on Fri Dec 15 19:43:30 GMT 2023 , Edited by admin on Fri Dec 15 19:43:30 GMT 2023
PRIMARY
CAS
27625-35-0
Created by admin on Fri Dec 15 19:43:30 GMT 2023 , Edited by admin on Fri Dec 15 19:43:30 GMT 2023
PRIMARY
EPA CompTox
DTXSID90865387
Created by admin on Fri Dec 15 19:43:30 GMT 2023 , Edited by admin on Fri Dec 15 19:43:30 GMT 2023
PRIMARY
PUBCHEM
520326
Created by admin on Fri Dec 15 19:43:30 GMT 2023 , Edited by admin on Fri Dec 15 19:43:30 GMT 2023
PRIMARY
FDA UNII
7LGN25Y6EK
Created by admin on Fri Dec 15 19:43:30 GMT 2023 , Edited by admin on Fri Dec 15 19:43:30 GMT 2023
PRIMARY