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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

Molecular Formula C7H2Cl3O2
Molecular Weight 224.449
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

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 11:18:27 GMT 2023
Edited
by admin
on Sat Dec 16 11:18:27 GMT 2023
Record UNII
88PLG61CSH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SODIUM 2,4,5-TRICHLOROBENZOIC ACID
Systematic Name English
BENZOIC ACID, 2,4,5-TRICHLORO-, SODIUM SALT
Common 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 Sat Dec 16 11:18:27 GMT 2023 , Edited by admin on Sat Dec 16 11:18:27 GMT 2023
PRIMARY
PUBCHEM
119025624
Created by admin on Sat Dec 16 11:18:27 GMT 2023 , Edited by admin on Sat Dec 16 11:18:27 GMT 2023
PRIMARY
FDA UNII
88PLG61CSH
Created by admin on Sat Dec 16 11:18:27 GMT 2023 , Edited by admin on Sat Dec 16 11:18:27 GMT 2023
PRIMARY
EPA CompTox
DTXSID401033282
Created by admin on Sat Dec 16 11:18:27 GMT 2023 , Edited by admin on Sat Dec 16 11:18:27 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT