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Details

Stereochemistry ACHIRAL
Molecular Formula C8H16O2
Molecular Weight 144.2114
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PROPYL ISOVALERATE

SMILES

CCCOC(=O)CC(C)C

InChI

InChIKey=LSJMDWFAADPNAX-UHFFFAOYSA-N
InChI=1S/C8H16O2/c1-4-5-10-8(9)6-7(2)3/h7H,4-6H2,1-3H3

HIDE SMILES / InChI

Approval Year

Patents

Patents

Name Type Language
PROPYL ISOVALERATE
FHFI  
Systematic Name English
FEMA NO. 2960
Preferred Name English
PROPYL 3-METHYLBUTANOATE
Systematic Name English
PROPYL 3-METHYLBUTYRATE
Systematic Name English
PROPYL ISOVALERATE [FHFI]
Common Name English
ISOVALERIC ACID, PROPYL ESTER
Common Name English
PROPYL ISOPENTANOATE
Systematic Name English
BUTANOIC ACID, 3-METHYL-, PROPYL ESTER
Common Name English
Classification Tree Code System Code
JECFA EVALUATION PROPYL ISOVALERATE
Created by admin on Mon Mar 31 19:21:08 GMT 2025 , Edited by admin on Mon Mar 31 19:21:08 GMT 2025
CFR 21 CFR 172.515
Created by admin on Mon Mar 31 19:21:08 GMT 2025 , Edited by admin on Mon Mar 31 19:21:08 GMT 2025
Code System Code Type Description
PUBCHEM
11176
Created by admin on Mon Mar 31 19:21:08 GMT 2025 , Edited by admin on Mon Mar 31 19:21:08 GMT 2025
PRIMARY
FDA UNII
802KM69CKR
Created by admin on Mon Mar 31 19:21:08 GMT 2025 , Edited by admin on Mon Mar 31 19:21:08 GMT 2025
PRIMARY
EPA CompTox
DTXSID70204230
Created by admin on Mon Mar 31 19:21:08 GMT 2025 , Edited by admin on Mon Mar 31 19:21:08 GMT 2025
PRIMARY
CAS
557-00-6
Created by admin on Mon Mar 31 19:21:08 GMT 2025 , Edited by admin on Mon Mar 31 19:21:08 GMT 2025
PRIMARY
JECFA MONOGRAPH
203
Created by admin on Mon Mar 31 19:21:08 GMT 2025 , Edited by admin on Mon Mar 31 19:21:08 GMT 2025
PRIMARY
ECHA (EC/EINECS)
209-148-2
Created by admin on Mon Mar 31 19:21:08 GMT 2025 , Edited by admin on Mon Mar 31 19:21:08 GMT 2025
PRIMARY