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Details

Stereochemistry ACHIRAL
Molecular Formula C8H14O2
Molecular Weight 142.1956
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ALLYL ISOVALERATE

SMILES

CC(C)CC(=O)OCC=C

InChI

InChIKey=HOMAGVUCNZNWBC-UHFFFAOYSA-N
InChI=1S/C8H14O2/c1-4-5-10-8(9)6-7(2)3/h4,7H,1,5-6H2,2-3H3

HIDE SMILES / InChI

Molecular Formula C8H14O2
Molecular Weight 142.1956
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 Fri Dec 15 17:04:10 GMT 2023
Edited
by admin
on Fri Dec 15 17:04:10 GMT 2023
Record UNII
3551Z86V7T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ALLYL ISOVALERATE
FCC   FHFI   HSDB  
Systematic Name English
BUTANOIC ACID, 3-METHYL-, 2-PROPENYL ESTER
Common Name English
ALLYL ISOPENTANOATE
Systematic Name English
ALLYL ISOVALERATE [HSDB]
Common Name English
ALLYL ISOVALERATE [IARC]
Common Name English
NSC-18606
Code English
ALLYL ISOVALERATE [FCC]
Common Name English
BUTANOIC ACID, 3-METHYL-, 2-PROPEN-1-YL ESTER
Common Name English
FEMA NO. 2045
Code English
ALLYL ISOVALERATE [FHFI]
Common Name English
ISOVALERIC ACID, ALLYL ESTER
Common Name English
Classification Tree Code System Code
CFR 21 CFR 172.515
Created by admin on Fri Dec 15 17:04:11 GMT 2023 , Edited by admin on Fri Dec 15 17:04:11 GMT 2023
JECFA EVALUATION ALLYL ISOVALERATE
Created by admin on Fri Dec 15 17:04:11 GMT 2023 , Edited by admin on Fri Dec 15 17:04:11 GMT 2023
Code System Code Type Description
PUBCHEM
17816
Created by admin on Fri Dec 15 17:04:11 GMT 2023 , Edited by admin on Fri Dec 15 17:04:11 GMT 2023
PRIMARY
HSDB
4183
Created by admin on Fri Dec 15 17:04:11 GMT 2023 , Edited by admin on Fri Dec 15 17:04:11 GMT 2023
PRIMARY
ECHA (EC/EINECS)
220-609-7
Created by admin on Fri Dec 15 17:04:11 GMT 2023 , Edited by admin on Fri Dec 15 17:04:11 GMT 2023
PRIMARY
CAS
2835-39-4
Created by admin on Fri Dec 15 17:04:11 GMT 2023 , Edited by admin on Fri Dec 15 17:04:11 GMT 2023
PRIMARY
JECFA MONOGRAPH
325
Created by admin on Fri Dec 15 17:04:11 GMT 2023 , Edited by admin on Fri Dec 15 17:04:11 GMT 2023
PRIMARY
NSC
18606
Created by admin on Fri Dec 15 17:04:11 GMT 2023 , Edited by admin on Fri Dec 15 17:04:11 GMT 2023
PRIMARY
MESH
C047023
Created by admin on Fri Dec 15 17:04:11 GMT 2023 , Edited by admin on Fri Dec 15 17:04:11 GMT 2023
PRIMARY
FDA UNII
3551Z86V7T
Created by admin on Fri Dec 15 17:04:11 GMT 2023 , Edited by admin on Fri Dec 15 17:04:11 GMT 2023
PRIMARY
EPA CompTox
DTXSID4039233
Created by admin on Fri Dec 15 17:04:11 GMT 2023 , Edited by admin on Fri Dec 15 17:04:11 GMT 2023
PRIMARY