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Details

Stereochemistry ACHIRAL
Molecular Formula C7H6ClNO2
Molecular Weight 171.581
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-AMINO-3-CHLOROBENZOIC ACID

SMILES

NC1=C(Cl)C=C(C=C1)C(O)=O

InChI

InChIKey=YIYBPEDZAUFQLO-UHFFFAOYSA-N
InChI=1S/C7H6ClNO2/c8-5-3-4(7(10)11)1-2-6(5)9/h1-3H,9H2,(H,10,11)

HIDE SMILES / InChI

Molecular Formula C7H6ClNO2
Molecular Weight 171.581
Charge 0
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 12:17:36 GMT 2023
Edited
by admin
on Sat Dec 16 12:17:36 GMT 2023
Record UNII
GBC9H9RW4T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-AMINO-3-CHLOROBENZOIC ACID
Systematic Name English
NSC-212132
Code English
3-Chloro-4-aminobenzoic acid
Systematic Name English
Benzoic acid, 4-amino-3-chloro-
Systematic Name English
Code System Code Type Description
PUBCHEM
17211
Created by admin on Sat Dec 16 12:17:36 GMT 2023 , Edited by admin on Sat Dec 16 12:17:36 GMT 2023
PRIMARY
CAS
2486-71-7
Created by admin on Sat Dec 16 12:17:36 GMT 2023 , Edited by admin on Sat Dec 16 12:17:36 GMT 2023
PRIMARY
ECHA (EC/EINECS)
219-630-4
Created by admin on Sat Dec 16 12:17:36 GMT 2023 , Edited by admin on Sat Dec 16 12:17:36 GMT 2023
PRIMARY
EPA CompTox
DTXSID00179563
Created by admin on Sat Dec 16 12:17:36 GMT 2023 , Edited by admin on Sat Dec 16 12:17:36 GMT 2023
PRIMARY
FDA UNII
GBC9H9RW4T
Created by admin on Sat Dec 16 12:17:36 GMT 2023 , Edited by admin on Sat Dec 16 12:17:36 GMT 2023
PRIMARY
NSC
212132
Created by admin on Sat Dec 16 12:17:36 GMT 2023 , Edited by admin on Sat Dec 16 12:17:36 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT