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Details

Stereochemistry ACHIRAL
Molecular Formula C10H12O2S
Molecular Weight 196.266
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHYL 4-(METHYLTHIO)BENZOATE

SMILES

CCC(=O)OC1=CC=C(SC)C=C1

InChI

InChIKey=WYPVLVXZQULUBC-UHFFFAOYSA-N
InChI=1S/C10H12O2S/c1-3-10(11)12-8-4-6-9(13-2)7-5-8/h4-7H,3H2,1-2H3

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
ETHYL 4-(METHYLTHIO)BENZOATE
Systematic Name English
BENZOIC ACID, 4-(METHYLTHIO)-, ETHYL ESTER
Systematic Name English
Code System Code Type Description
PUBCHEM
131635477
Created by admin on Fri Dec 15 15:47:43 GMT 2023 , Edited by admin on Fri Dec 15 15:47:43 GMT 2023
PRIMARY
FDA UNII
QI07X3ITD3
Created by admin on Fri Dec 15 15:47:43 GMT 2023 , Edited by admin on Fri Dec 15 15:47:43 GMT 2023
PRIMARY
CAS
1778-10-5
Created by admin on Fri Dec 15 15:47:43 GMT 2023 , Edited by admin on Fri Dec 15 15:47:43 GMT 2023
PRIMARY
NIH
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