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Details

Stereochemistry ACHIRAL
Molecular Formula C7H4ClO2.Na
Molecular Weight 178.548
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM O-CHLOROBENZOATE

SMILES

[Na+].[O-]C(=O)C1=CC=CC=C1Cl

InChI

InChIKey=OJLSABVGUWNJKD-UHFFFAOYSA-M
InChI=1S/C7H5ClO2.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4H,(H,9,10);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C7H4ClO2
Molecular Weight 155.558
Charge -1
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Na
Molecular Weight 22.98976928
Charge 1
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

Substance Class Chemical
Record UNII
5Q884Z4ERN
Record Status Validated (UNII)
Record Version