U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C7H2Cl3O2.Na
Molecular Weight 247.438
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM 2,4,5-TRICHLOROBENZOIC ACID

SMILES

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

InChI

InChIKey=HCWXYFFDSRCTAG-UHFFFAOYSA-M
InChI=1S/C7H3Cl3O2.Na/c8-4-2-6(10)5(9)1-3(4)7(11)12;/h1-2H,(H,11,12);/q;+1/p-1

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
BENZOIC ACID, 2,4,5-TRICHLORO-, SODIUM SALT
Preferred Name English
SODIUM 2,4,5-TRICHLOROBENZOIC ACID
Systematic Name English
BENZOIC ACID, 2,4,5-TRICHLORO-, SODIUM SALT (1:1)
Systematic Name English
Code System Code Type Description
CAS
72524-92-6
Created by admin on Mon Mar 31 23:45:45 GMT 2025 , Edited by admin on Mon Mar 31 23:45:45 GMT 2025
PRIMARY
PUBCHEM
119025624
Created by admin on Mon Mar 31 23:45:45 GMT 2025 , Edited by admin on Mon Mar 31 23:45:45 GMT 2025
PRIMARY
FDA UNII
88PLG61CSH
Created by admin on Mon Mar 31 23:45:45 GMT 2025 , Edited by admin on Mon Mar 31 23:45:45 GMT 2025
PRIMARY
EPA CompTox
DTXSID401033282
Created by admin on Mon Mar 31 23:45:45 GMT 2025 , Edited by admin on Mon Mar 31 23:45:45 GMT 2025
PRIMARY
SALT/SOLVATE (PARENT)
Structure of 2,4,5-TRICHLOROBENZOIC ACID
NIH
NCATS
PRIVACY NOTICE
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966