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Details

Stereochemistry ABSOLUTE
Molecular Formula C9H20OS
Molecular Weight 176.32
Optical Activity ( + )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-[(S)-Methylsulfinyl]octane

SMILES

CCCCCCCC[S@](C)=O

InChI

InChIKey=PVVATGNFHKTPTA-NSHDSACASA-N
InChI=1S/C9H20OS/c1-3-4-5-6-7-8-9-11(2)10/h3-9H2,1-2H3/t11-/m0/s1

HIDE SMILES / InChI

Molecular Formula C9H20OS
Molecular Weight 176.32
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 18:42:46 GMT 2025
Edited
by admin
on Wed Apr 02 18:42:46 GMT 2025
Record UNII
SNZ4LWX3BA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(S)-Methyl n-octyl sulfoxide
Preferred Name English
1-[(S)-Methylsulfinyl]octane
Systematic Name English
Octane, 1-(methylsulfinyl)-, (S)-
Systematic Name English
N-octylmethyl sulfoxide, (S)-
Systematic Name English
Octane, 1-[(S)-methylsulfinyl]-
Systematic Name English
(S)-(+)-Methyl n-octyl sulfoxide
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID701309040
Created by admin on Wed Apr 02 18:42:46 GMT 2025 , Edited by admin on Wed Apr 02 18:42:46 GMT 2025
PRIMARY
FDA UNII
SNZ4LWX3BA
Created by admin on Wed Apr 02 18:42:46 GMT 2025 , Edited by admin on Wed Apr 02 18:42:46 GMT 2025
PRIMARY
CAS
131002-32-9
Created by admin on Wed Apr 02 18:42:46 GMT 2025 , Edited by admin on Wed Apr 02 18:42:46 GMT 2025
PRIMARY
PUBCHEM
10997588
Created by admin on Wed Apr 02 18:42:46 GMT 2025 , Edited by admin on Wed Apr 02 18:42:46 GMT 2025
PRIMARY
Related Record Type Details
ENANTIOMER -> ENANTIOMER