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Details

Stereochemistry RACEMIC
Molecular Formula C14H12O3S
Molecular Weight 260.308
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (2RS)-2-(5-BENZOYLTHIOPHEN-3-YL)PROPANOIC ACID

SMILES

CC(C(O)=O)C1=CSC(=C1)C(=O)C2=CC=CC=C2

InChI

InChIKey=BUBACEWLLQCUAX-UHFFFAOYSA-N
InChI=1S/C14H12O3S/c1-9(14(16)17)11-7-12(18-8-11)13(15)10-5-3-2-4-6-10/h2-9H,1H3,(H,16,17)

HIDE SMILES / InChI

Molecular Formula C14H12O3S
Molecular Weight 260.308
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:46:55 UTC 2023
Edited
by admin
on Sat Dec 16 14:46:55 UTC 2023
Record UNII
MO0RL8X6B8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(2RS)-2-(5-BENZOYLTHIOPHEN-3-YL)PROPANOIC ACID
Systematic Name English
TIAPROFENIC ACID IMPURITY C [EP IMPURITY]
Common Name English
5-BENZOYL-.ALPHA.-METHYL-3-THIOPHENEACETIC ACID
Systematic Name English
3-THIOPHENEACETIC ACID, 5-BENZOYL-.ALPHA.-METHYL-
Systematic Name English
Code System Code Type Description
FDA UNII
MO0RL8X6B8
Created by admin on Sat Dec 16 14:46:55 UTC 2023 , Edited by admin on Sat Dec 16 14:46:55 UTC 2023
PRIMARY
PUBCHEM
13134869
Created by admin on Sat Dec 16 14:46:55 UTC 2023 , Edited by admin on Sat Dec 16 14:46:55 UTC 2023
PRIMARY
CAS
78239-47-1
Created by admin on Sat Dec 16 14:46:55 UTC 2023 , Edited by admin on Sat Dec 16 14:46:55 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP