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Details

Stereochemistry ACHIRAL
Molecular Formula C12H8O3S
Molecular Weight 232.255
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-BENZOYL-2-THIOPHENECARBOXYLIC ACID

SMILES

OC(=O)C1=C(C=CS1)C(=O)C2=CC=CC=C2

InChI

InChIKey=ZKHLBCVFVQJMBT-UHFFFAOYSA-N
InChI=1S/C12H8O3S/c13-10(8-4-2-1-3-5-8)9-6-7-16-11(9)12(14)15/h1-7H,(H,14,15)

HIDE SMILES / InChI

Molecular Formula C12H8O3S
Molecular Weight 232.255
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 12:41:30 GMT 2023
Edited
by admin
on Sat Dec 16 12:41:30 GMT 2023
Record UNII
Q4K02HKZ9P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-BENZOYL-2-THIOPHENECARBOXYLIC ACID
Systematic Name English
NSC-241104
Code English
2-THIOPHENECARBOXYLIC ACID, 3-BENZOYL-
Systematic Name English
3-BENZOYLTHIOPHENE-2-CARBOXYLIC ACID
Systematic Name English
Code System Code Type Description
NSC
241104
Created by admin on Sat Dec 16 12:41:30 GMT 2023 , Edited by admin on Sat Dec 16 12:41:30 GMT 2023
PRIMARY
EPA CompTox
DTXSID30184084
Created by admin on Sat Dec 16 12:41:30 GMT 2023 , Edited by admin on Sat Dec 16 12:41:30 GMT 2023
PRIMARY
PUBCHEM
315607
Created by admin on Sat Dec 16 12:41:30 GMT 2023 , Edited by admin on Sat Dec 16 12:41:30 GMT 2023
PRIMARY
CAS
30006-03-2
Created by admin on Sat Dec 16 12:41:30 GMT 2023 , Edited by admin on Sat Dec 16 12:41:30 GMT 2023
PRIMARY
FDA UNII
Q4K02HKZ9P
Created by admin on Sat Dec 16 12:41:30 GMT 2023 , Edited by admin on Sat Dec 16 12:41:30 GMT 2023
PRIMARY