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

Details

Stereochemistry ACHIRAL
Molecular Formula C12H9NO2
Molecular Weight 199.2054
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(PYRIDIN-2-YL)BENZOIC ACID

SMILES

OC(=O)C1=CC=C(C=C1)C2=CC=CC=N2

InChI

InChIKey=AQIPNZHMXANQRC-UHFFFAOYSA-N
InChI=1S/C12H9NO2/c14-12(15)10-6-4-9(5-7-10)11-3-1-2-8-13-11/h1-8H,(H,14,15)

HIDE SMILES / InChI

Molecular Formula C12H9NO2
Molecular Weight 199.2054
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 11:16:55 GMT 2023
Edited
by admin
on Sat Dec 16 11:16:55 GMT 2023
Record UNII
43R8HY6XXL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-(PYRIDIN-2-YL)BENZOIC ACID
Systematic Name English
ATAZANAVIR SULFATE IMPURITY A [EP IMPURITY]
Common Name English
BENZOIC ACID, 4-(2-PYRIDINYL)-
Systematic Name English
Code System Code Type Description
PUBCHEM
821692
Created by admin on Sat Dec 16 11:16:55 GMT 2023 , Edited by admin on Sat Dec 16 11:16:55 GMT 2023
PRIMARY
EPA CompTox
DTXSID50356322
Created by admin on Sat Dec 16 11:16:55 GMT 2023 , Edited by admin on Sat Dec 16 11:16:55 GMT 2023
PRIMARY
FDA UNII
43R8HY6XXL
Created by admin on Sat Dec 16 11:16:55 GMT 2023 , Edited by admin on Sat Dec 16 11:16:55 GMT 2023
PRIMARY
CAS
4385-62-0
Created by admin on Sat Dec 16 11:16:55 GMT 2023 , Edited by admin on Sat Dec 16 11:16:55 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY