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Details

Stereochemistry ACHIRAL
Molecular Formula C7HCl5O2
Molecular Weight 294.347
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Pentachlorobenzoic acid

SMILES

OC(=O)C1=C(Cl)C(Cl)=C(Cl)C(Cl)=C1Cl

InChI

InChIKey=IONYGGJUUJFXJK-UHFFFAOYSA-N
InChI=1S/C7HCl5O2/c8-2-1(7(13)14)3(9)5(11)6(12)4(2)10/h(H,13,14)

HIDE SMILES / InChI

Approval Year

Name Type Language
Pentachlorobenzoic acid
Systematic Name English
NSC-155867
Preferred Name English
Perchlorobenzoic acid
Common Name English
Benzoic acid, pentachloro-
Systematic Name English
Benzoic acid, 2,3,4,5,6-pentachloro-
Systematic Name English
2,3,4,5,6-Pentachlorobenzoic acid
Systematic Name English
AI3-34818
Code English
Code System Code Type Description
CAS
1012-84-6
Created by admin on Tue Apr 01 19:53:42 GMT 2025 , Edited by admin on Tue Apr 01 19:53:42 GMT 2025
PRIMARY
PUBCHEM
13896
Created by admin on Tue Apr 01 19:53:42 GMT 2025 , Edited by admin on Tue Apr 01 19:53:42 GMT 2025
PRIMARY
FDA UNII
F9BV6ZF9TG
Created by admin on Tue Apr 01 19:53:42 GMT 2025 , Edited by admin on Tue Apr 01 19:53:42 GMT 2025
PRIMARY
EPA CompTox
DTXSID5074420
Created by admin on Tue Apr 01 19:53:42 GMT 2025 , Edited by admin on Tue Apr 01 19:53:42 GMT 2025
PRIMARY
NSC
155867
Created by admin on Tue Apr 01 19:53:42 GMT 2025 , Edited by admin on Tue Apr 01 19:53:42 GMT 2025
PRIMARY