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Details

Stereochemistry ACHIRAL
Molecular Formula C13H12OS
Molecular Weight 216.299
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of P-(PHENYLTHIO)BENZYL ALCOHOL

SMILES

OCC1=CC=C(SC2=CC=CC=C2)C=C1

InChI

InChIKey=PGOAWMRWDZJQTB-UHFFFAOYSA-N
InChI=1S/C13H12OS/c14-10-11-6-8-13(9-7-11)15-12-4-2-1-3-5-12/h1-9,14H,10H2

HIDE SMILES / InChI

Molecular Formula C13H12OS
Molecular Weight 216.299
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 19:13:19 GMT 2025
Edited
by admin
on Tue Apr 01 19:13:19 GMT 2025
Record UNII
TMD9BW7WU5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
P-(PHENYLTHIO)BENZYL ALCOHOL
Common Name English
NSC-43060
Preferred Name English
(4-(PHENYLSULFANYL)PHENYL)METHANOL
Systematic Name English
4-(PHENYLTHIO)BENZENEMETHANOL
Systematic Name English
4-(PHENYLTHIO)BENZYL ALCOHOL
Systematic Name English
BENZENEMETHANOL, 4-(PHENYLTHIO)-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
228-658-6
Created by admin on Tue Apr 01 19:13:19 GMT 2025 , Edited by admin on Tue Apr 01 19:13:19 GMT 2025
PRIMARY
FDA UNII
TMD9BW7WU5
Created by admin on Tue Apr 01 19:13:19 GMT 2025 , Edited by admin on Tue Apr 01 19:13:19 GMT 2025
PRIMARY
NSC
43060
Created by admin on Tue Apr 01 19:13:19 GMT 2025 , Edited by admin on Tue Apr 01 19:13:19 GMT 2025
PRIMARY
CAS
6317-56-2
Created by admin on Tue Apr 01 19:13:19 GMT 2025 , Edited by admin on Tue Apr 01 19:13:19 GMT 2025
PRIMARY
PUBCHEM
80593
Created by admin on Tue Apr 01 19:13:19 GMT 2025 , Edited by admin on Tue Apr 01 19:13:19 GMT 2025
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EPA CompTox
DTXSID10212511
Created by admin on Tue Apr 01 19:13:19 GMT 2025 , Edited by admin on Tue Apr 01 19:13:19 GMT 2025
PRIMARY