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Details

Stereochemistry RACEMIC
Molecular Formula C8H10S
Molecular Weight 138.23
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-PHENYLETHANETHIOL

SMILES

CC(S)C1=CC=CC=C1

InChI

InChIKey=QZZBJCFNHPYNKO-UHFFFAOYSA-N
InChI=1S/C8H10S/c1-7(9)8-5-3-2-4-6-8/h2-7,9H,1H3

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

TitleDatePubMed
1-Phenyl-1-[(1-phenyl-ethyl)sulfonyl-methyl-sulfon-yl]ethane.
2009-11-25
Recent improvements in the development of A(2B) adenosine receptor agonists.
2008-12
Patents

Patents

Name Type Language
1-PHENYLETHANETHIOL
Systematic Name English
(±)-1-PHENYLETHYLMERCAPTAN
FHFI  
Preferred Name English
FEMA NO. 4061
Code English
BENZENEMETHANETHIOL, .ALPHA.-METHYL-
Systematic Name English
.ALPHA.-METHYLBENZENEMETHANETHIOL
Systematic Name English
.ALPHA.-METHYL-.ALPHA.-TOLUENETHIOL
Systematic Name English
.ALPHA.-METHYLBENZYL THIOL
Systematic Name English
ETHANETHIOL, 1-PHENYL-
Systematic Name English
1-PHENYLETHYLMERCAPTAN, (±)-
Systematic Name English
.ALPHA.-TOLUENETHIOL, .ALPHA.-METHYL-
Systematic Name English
(±)-1-PHENYLETHYLMERCAPTAN [FHFI]
Common Name English
NSC-66561
Code English
Classification Tree Code System Code
JECFA EVALUATION (+/-)-1-PHENYLETHYLMERCAPTAN
Created by admin on Mon Mar 31 20:15:26 GMT 2025 , Edited by admin on Mon Mar 31 20:15:26 GMT 2025
Code System Code Type Description
NSC
66561
Created by admin on Mon Mar 31 20:15:26 GMT 2025 , Edited by admin on Mon Mar 31 20:15:26 GMT 2025
PRIMARY
MESH
C106744
Created by admin on Mon Mar 31 20:15:26 GMT 2025 , Edited by admin on Mon Mar 31 20:15:26 GMT 2025
PRIMARY
PUBCHEM
141850
Created by admin on Mon Mar 31 20:15:26 GMT 2025 , Edited by admin on Mon Mar 31 20:15:26 GMT 2025
PRIMARY
CAS
6263-65-6
Created by admin on Mon Mar 31 20:15:26 GMT 2025 , Edited by admin on Mon Mar 31 20:15:26 GMT 2025
PRIMARY
EPA CompTox
DTXSID60863734
Created by admin on Mon Mar 31 20:15:26 GMT 2025 , Edited by admin on Mon Mar 31 20:15:26 GMT 2025
PRIMARY
JECFA MONOGRAPH
1653
Created by admin on Mon Mar 31 20:15:26 GMT 2025 , Edited by admin on Mon Mar 31 20:15:26 GMT 2025
PRIMARY
FDA UNII
62EE7Q6MB0
Created by admin on Mon Mar 31 20:15:26 GMT 2025 , Edited by admin on Mon Mar 31 20:15:26 GMT 2025
PRIMARY