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Details

Stereochemistry ACHIRAL
Molecular Formula C9H8ClO3.Na
Molecular Weight 222.601
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM 3-(3-CHLOROPHENOXY)PROPIONATE

SMILES

[Na+].[O-]C(=O)CCOC1=CC=CC(Cl)=C1

InChI

InChIKey=BFZYCNGAQXXVRF-UHFFFAOYSA-M
InChI=1S/C9H9ClO3.Na/c10-7-2-1-3-8(6-7)13-5-4-9(11)12;/h1-3,6H,4-5H2,(H,11,12);/q;+1/p-1

HIDE SMILES / InChI

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

Molecular Formula C9H8ClO3
Molecular Weight 199.611
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

Substance Class Chemical
Record UNII
E26A3X8BKZ
Record Status Validated (UNII)
Record Version