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Details

Stereochemistry ACHIRAL
Molecular Formula C6H14S
Molecular Weight 118.24
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Diisopropyl sulfide

SMILES

CC(C)SC(C)C

InChI

InChIKey=XYWDPYKBIRQXQS-UHFFFAOYSA-N
InChI=1S/C6H14S/c1-5(2)7-6(3)4/h5-6H,1-4H3

HIDE SMILES / InChI

Molecular Formula C6H14S
Molecular Weight 118.24
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 Wed Apr 02 11:33:23 GMT 2025
Edited
by admin
on Wed Apr 02 11:33:23 GMT 2025
Record UNII
FJW5HJJ2ZJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-75121
Preferred Name English
Diisopropyl sulfide
Systematic Name English
Di-isopropyl sulfide
Systematic Name English
2,4-Dimethyl-3-thiapentane
Systematic Name English
Propane, 2,2?-thiobis-
Systematic Name English
2,2?-Thiobispropane
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID0060808
Created by admin on Wed Apr 02 11:33:23 GMT 2025 , Edited by admin on Wed Apr 02 11:33:23 GMT 2025
PRIMARY
NSC
75121
Created by admin on Wed Apr 02 11:33:23 GMT 2025 , Edited by admin on Wed Apr 02 11:33:23 GMT 2025
PRIMARY
CAS
625-80-9
Created by admin on Wed Apr 02 11:33:23 GMT 2025 , Edited by admin on Wed Apr 02 11:33:23 GMT 2025
PRIMARY
PUBCHEM
12264
Created by admin on Wed Apr 02 11:33:23 GMT 2025 , Edited by admin on Wed Apr 02 11:33:23 GMT 2025
PRIMARY
ECHA (EC/EINECS)
210-911-7
Created by admin on Wed Apr 02 11:33:23 GMT 2025 , Edited by admin on Wed Apr 02 11:33:23 GMT 2025
PRIMARY
FDA UNII
FJW5HJJ2ZJ
Created by admin on Wed Apr 02 11:33:23 GMT 2025 , Edited by admin on Wed Apr 02 11:33:23 GMT 2025
PRIMARY