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Details

Stereochemistry ACHIRAL
Molecular Formula C12H10O2S
Molecular Weight 218.272
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Thienylmethyl benzoate

SMILES

O=C(OCC1=CC=CS1)C2=CC=CC=C2

InChI

InChIKey=QFKZQXHPVSHDMJ-UHFFFAOYSA-N
InChI=1S/C12H10O2S/c13-12(10-5-2-1-3-6-10)14-9-11-7-4-8-15-11/h1-8H,9H2

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
2-Thienylmethyl benzoate
Systematic Name English
2-Thenyl benzoate
Preferred Name English
2-Thiophenemethanol, 2-benzoate
Systematic Name English
2-Thiophenemethanol, benzoate
Systematic Name English
Thiophen-2-ylmethyl benzoate
Systematic Name English
Code System Code Type Description
PUBCHEM
3020751
Created by admin on Tue Apr 01 19:16:22 GMT 2025 , Edited by admin on Tue Apr 01 19:16:22 GMT 2025
PRIMARY
EPA CompTox
DTXSID70234678
Created by admin on Tue Apr 01 19:16:22 GMT 2025 , Edited by admin on Tue Apr 01 19:16:22 GMT 2025
PRIMARY
ECHA (EC/EINECS)
287-300-7
Created by admin on Tue Apr 01 19:16:22 GMT 2025 , Edited by admin on Tue Apr 01 19:16:22 GMT 2025
PRIMARY
FDA UNII
T6UJD565HM
Created by admin on Tue Apr 01 19:16:22 GMT 2025 , Edited by admin on Tue Apr 01 19:16:22 GMT 2025
PRIMARY
CAS
85455-66-9
Created by admin on Tue Apr 01 19:16:22 GMT 2025 , Edited by admin on Tue Apr 01 19:16:22 GMT 2025
PRIMARY
NIH
NCATS
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