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Details

Stereochemistry ACHIRAL
Molecular Formula C13H12O2S
Molecular Weight 232.298
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Benzyl 3-thienylacetate

SMILES

O=C(CC1=CSC=C1)OCC2=CC=CC=C2

InChI

InChIKey=AFYCAIBLAZNEIZ-UHFFFAOYSA-N
InChI=1S/C13H12O2S/c14-13(8-12-6-7-16-10-12)15-9-11-4-2-1-3-5-11/h1-7,10H,8-9H2

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
3-Thiopheneacetic acid, phenylmethyl ester
Preferred Name English
Benzyl 3-thienylacetate
Systematic Name English
Benzyl 2-(thiophen-3-yl)acetate
Systematic Name English
Code System Code Type Description
CAS
50893-37-3
Created by admin on Wed Apr 02 20:07:08 GMT 2025 , Edited by admin on Wed Apr 02 20:07:08 GMT 2025
PRIMARY
FDA UNII
9P5V5Q6PMA
Created by admin on Wed Apr 02 20:07:08 GMT 2025 , Edited by admin on Wed Apr 02 20:07:08 GMT 2025
PRIMARY
EPA CompTox
DTXSID10965131
Created by admin on Wed Apr 02 20:07:08 GMT 2025 , Edited by admin on Wed Apr 02 20:07:08 GMT 2025
PRIMARY
PUBCHEM
3016572
Created by admin on Wed Apr 02 20:07:08 GMT 2025 , Edited by admin on Wed Apr 02 20:07:08 GMT 2025
PRIMARY
NIH
NCATS
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