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Details

Stereochemistry ACHIRAL
Molecular Formula C5H9O2.H4N
Molecular Weight 119.1622
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AMMONIUM ISOVALERATE

SMILES

[NH4+].CC(C)CC([O-])=O

InChI

InChIKey=RKCHCKMAQPJXBM-UHFFFAOYSA-N
InChI=1S/C5H10O2.H3N/c1-4(2)3-5(6)7;/h4H,3H2,1-2H3,(H,6,7);1H3

HIDE SMILES / InChI

Molecular Formula C5H10O2
Molecular Weight 102.1317
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula H3N
Molecular Weight 17.0305
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 18:04:36 UTC 2023
Edited
by admin
on Fri Dec 15 18:04:36 UTC 2023
Record UNII
47DWA95M3X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AMMONIUM ISOVALERATE
FHFI  
Systematic Name English
AMMONIUM ISOVALERATE 30% IN PG
Common Name English
3-AMMONIUM ISOVALERATE
Common Name English
BUTANOIC ACID, 3-METHYL-, AMMONIUM SALT (1:1)
Common Name English
FEMA NO. 2054
Code English
AMMONIUM ISOVALERATE [FHFI]
Common Name English
AMMONIUM 3-METHYLBUTYRATE
Systematic Name English
ISOVALERIC ACID, AMMONIUM SALT
Common Name English
Classification Tree Code System Code
JECFA EVALUATION AMMONIUM ISOVALERATE
Created by admin on Fri Dec 15 18:04:36 UTC 2023 , Edited by admin on Fri Dec 15 18:04:36 UTC 2023
CFR 21 CFR 172.515
Created by admin on Fri Dec 15 18:04:36 UTC 2023 , Edited by admin on Fri Dec 15 18:04:36 UTC 2023
Code System Code Type Description
EPA CompTox
DTXSID00226541
Created by admin on Fri Dec 15 18:04:36 UTC 2023 , Edited by admin on Fri Dec 15 18:04:36 UTC 2023
PRIMARY
CAS
7563-33-9
Created by admin on Fri Dec 15 18:04:36 UTC 2023 , Edited by admin on Fri Dec 15 18:04:36 UTC 2023
PRIMARY
FDA UNII
47DWA95M3X
Created by admin on Fri Dec 15 18:04:36 UTC 2023 , Edited by admin on Fri Dec 15 18:04:36 UTC 2023
PRIMARY
PUBCHEM
61419
Created by admin on Fri Dec 15 18:04:36 UTC 2023 , Edited by admin on Fri Dec 15 18:04:36 UTC 2023
PRIMARY
JECFA MONOGRAPH
1212
Created by admin on Fri Dec 15 18:04:36 UTC 2023 , Edited by admin on Fri Dec 15 18:04:36 UTC 2023
PRIMARY
ECHA (EC/EINECS)
231-458-1
Created by admin on Fri Dec 15 18:04:36 UTC 2023 , Edited by admin on Fri Dec 15 18:04:36 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE