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Details

Stereochemistry RACEMIC
Molecular Formula C5H9O3.Na
Molecular Weight 140.1129
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM .ALPHA.-HYDROXYISOVALERATE

SMILES

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

InChI

InChIKey=CPGHJLCKGBLVMB-UHFFFAOYSA-M
InChI=1S/C5H10O3.Na/c1-3(2)4(6)5(7)8;/h3-4,6H,1-2H3,(H,7,8);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C5H9O3
Molecular Weight 117.1232
Charge -1
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
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 Sat Dec 16 07:09:27 UTC 2023
Edited
by admin
on Sat Dec 16 07:09:27 UTC 2023
Record UNII
4M5OTC1X2O
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SODIUM .ALPHA.-HYDROXYISOVALERATE
Systematic Name English
BUTANOIC ACID, 2-HYDROXY-3-METHYL-, MONOSODIUM SALT
Systematic Name English
BUTANOIC ACID, 2-HYDROXY-3-METHYL-, SODIUM SALT (1:1)
Systematic Name English
Code System Code Type Description
PUBCHEM
23684609
Created by admin on Sat Dec 16 07:09:27 UTC 2023 , Edited by admin on Sat Dec 16 07:09:27 UTC 2023
PRIMARY
EPA CompTox
DTXSID10973352
Created by admin on Sat Dec 16 07:09:27 UTC 2023 , Edited by admin on Sat Dec 16 07:09:27 UTC 2023
PRIMARY
ECHA (EC/EINECS)
260-937-8
Created by admin on Sat Dec 16 07:09:27 UTC 2023 , Edited by admin on Sat Dec 16 07:09:27 UTC 2023
PRIMARY
CAS
57768-96-4
Created by admin on Sat Dec 16 07:09:27 UTC 2023 , Edited by admin on Sat Dec 16 07:09:27 UTC 2023
PRIMARY
FDA UNII
4M5OTC1X2O
Created by admin on Sat Dec 16 07:09:27 UTC 2023 , Edited by admin on Sat Dec 16 07:09:27 UTC 2023
PRIMARY