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Details

Stereochemistry ACHIRAL
Molecular Formula C10H9O3.Na
Molecular Weight 200.1664
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM 3,4-DIMETHYLPHENYLGLYOXYLATE

SMILES

[Na+].CC1=C(C)C=C(C=C1)C(=O)C([O-])=O

InChI

InChIKey=NONMFFAJXFTYER-UHFFFAOYSA-M
InChI=1S/C10H10O3.Na/c1-6-3-4-8(5-7(6)2)9(11)10(12)13;/h3-5H,1-2H3,(H,12,13);/q;+1/p-1

HIDE SMILES / InChI

Approval Year

Name Type Language
SODIUM 3,4-DIMETHYLPHENYLGLYOXYLATE
Systematic Name English
SODIUM 3,4-DIMETHYLPHENYL-GLYOXYLATE
Systematic Name English
BENZENEACETIC ACID, 3,4-DIMETHYL-.ALPHA.-OXO-, SODIUM SALT
Common Name English
BENZENEACETIC ACID, 3,4-DIMETHYL-.ALPHA.-OXO-, SODIUM SALT (1:1)
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C851
Created by admin on Fri Dec 15 16:05:12 UTC 2023 , Edited by admin on Fri Dec 15 16:05:12 UTC 2023
Code System Code Type Description
NCI_THESAURUS
C87224
Created by admin on Fri Dec 15 16:05:12 UTC 2023 , Edited by admin on Fri Dec 15 16:05:12 UTC 2023
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CAS
81632-85-1
Created by admin on Fri Dec 15 16:05:12 UTC 2023 , Edited by admin on Fri Dec 15 16:05:12 UTC 2023
PRIMARY
PUBCHEM
23664290
Created by admin on Fri Dec 15 16:05:12 UTC 2023 , Edited by admin on Fri Dec 15 16:05:12 UTC 2023
PRIMARY
EPA CompTox
DTXSID0057837
Created by admin on Fri Dec 15 16:05:12 UTC 2023 , Edited by admin on Fri Dec 15 16:05:12 UTC 2023
PRIMARY
FDA UNII
25K35WQ32Q
Created by admin on Fri Dec 15 16:05:12 UTC 2023 , Edited by admin on Fri Dec 15 16:05:12 UTC 2023
PRIMARY