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Details

Stereochemistry ACHIRAL
Molecular Formula C11H14S2
Molecular Weight 210.359
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-METHYL-2-PHENYL-M-DITHIANE

SMILES

CC1(SCCCS1)C2=CC=CC=C2

InChI

InChIKey=CAVORIBXCDTNBO-UHFFFAOYSA-N
InChI=1S/C11H14S2/c1-11(12-8-5-9-13-11)10-6-3-2-4-7-10/h2-4,6-7H,5,8-9H2,1H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
NSC-47056
Preferred Name English
2-METHYL-2-PHENYL-M-DITHIANE
Systematic Name English
ACETOPHENONE TRIMETHYLENE DITHIOKETAL
Systematic Name English
ACETOPHENONE, CYCLIC TRIMETHYLENE MERCAPTOLE
Systematic Name English
1,3-DITHIANE, 2-METHYL-2-PHENYL-
Systematic Name English
2-METHYL-2-PHENYL-1,3-DITHIANE
Systematic Name English
Code System Code Type Description
NSC
47056
Created by admin on Tue Apr 01 19:31:42 GMT 2025 , Edited by admin on Tue Apr 01 19:31:42 GMT 2025
PRIMARY
FDA UNII
DKE4TIO6XH
Created by admin on Tue Apr 01 19:31:42 GMT 2025 , Edited by admin on Tue Apr 01 19:31:42 GMT 2025
PRIMARY
CAS
6331-22-2
Created by admin on Tue Apr 01 19:31:42 GMT 2025 , Edited by admin on Tue Apr 01 19:31:42 GMT 2025
PRIMARY
PUBCHEM
22788
Created by admin on Tue Apr 01 19:31:42 GMT 2025 , Edited by admin on Tue Apr 01 19:31:42 GMT 2025
PRIMARY
EPA CompTox
DTXSID30212699
Created by admin on Tue Apr 01 19:31:42 GMT 2025 , Edited by admin on Tue Apr 01 19:31:42 GMT 2025
PRIMARY
NIH
NCATS
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