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Details

Stereochemistry ACHIRAL
Molecular Formula C10H8N2O2
Molecular Weight 188.1827
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(1H-PYRAZOL-3-YL)BENZOIC ACID

SMILES

OC(=O)C1=CC=CC(=C1)C2=NNC=C2

InChI

InChIKey=RXZRBZWATRFHCS-UHFFFAOYSA-N
InChI=1S/C10H8N2O2/c13-10(14)8-3-1-2-7(6-8)9-4-5-11-12-9/h1-6H,(H,11,12)(H,13,14)

HIDE SMILES / InChI

Molecular Formula C10H8N2O2
Molecular Weight 188.1827
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 15:43:53 GMT 2023
Edited
by admin
on Sat Dec 16 15:43:53 GMT 2023
Record UNII
DR25BS8RW9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(1H-PYRAZOL-3-YL)BENZOIC ACID
Systematic Name English
Benzoic acid, 3-(1H-pyrazol-3-yl)-
Systematic Name English
Code System Code Type Description
FDA UNII
DR25BS8RW9
Created by admin on Sat Dec 16 15:43:53 GMT 2023 , Edited by admin on Sat Dec 16 15:43:53 GMT 2023
PRIMARY
EPA CompTox
DTXSID80383762
Created by admin on Sat Dec 16 15:43:53 GMT 2023 , Edited by admin on Sat Dec 16 15:43:53 GMT 2023
PRIMARY
PUBCHEM
2795542
Created by admin on Sat Dec 16 15:43:53 GMT 2023 , Edited by admin on Sat Dec 16 15:43:53 GMT 2023
PRIMARY
CAS
850375-11-0
Created by admin on Sat Dec 16 15:43:53 GMT 2023 , Edited by admin on Sat Dec 16 15:43:53 GMT 2023
PRIMARY