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Details

Stereochemistry ACHIRAL
Molecular Formula C4H10S
Molecular Weight 90.187
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL PROPYL SULPHIDE

SMILES

CCCSC

InChI

InChIKey=ZOASGOXWEHUTKZ-UHFFFAOYSA-N
InChI=1S/C4H10S/c1-3-4-5-2/h3-4H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C4H10S
Molecular Weight 90.187
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Three structurally homologous isothiocyanates exert "Janus" characteristics in human HepG2 cells.
2009-04
Simple physics-based analytical formulas for the potentials of mean force for the interaction of amino acid side chains in water. IV. Pairs of different hydrophobic side chains.
2008-09-11
Ruminal fermentation of propylene glycol and glycerol.
2007-08-22
Simple physics-based analytical formulas for the potentials of mean force for the interaction of amino acid side chains in water. 3. Calculation and parameterization of the potentials of mean force of pairs of identical hydrophobic side chains.
2007-03-22
Formation of amines and aldehydes from parent amino acids during thermal processing of cocoa and model systems: new insights into pathways of the strecker reaction.
2006-03-08
Modulation of cytochrome P450 enzymes by organosulfur compounds from garlic.
2005-12
Substance Class Chemical
Created
by admin
on Mon Mar 31 20:09:31 GMT 2025
Edited
by admin
on Mon Mar 31 20:09:31 GMT 2025
Record UNII
NXA8RQ27B3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METHYL PROPYL SULPHIDE
Systematic Name English
1-(METHYLTHIO)PROPANE
Preferred Name English
PROPYL METHYL SULFIDE
Systematic Name English
SULFIDE, METHYL PROPYL
Systematic Name English
METHYL PROPYL SULFIDE
Systematic Name English
FEMA NO. 4889
Code English
PROPANE, 1-(METHYLTHIO)-
Systematic Name English
2-THIAPENTANE
Systematic Name English
Code System Code Type Description
FDA UNII
NXA8RQ27B3
Created by admin on Mon Mar 31 20:09:31 GMT 2025 , Edited by admin on Mon Mar 31 20:09:31 GMT 2025
PRIMARY
CAS
3877-15-4
Created by admin on Mon Mar 31 20:09:31 GMT 2025 , Edited by admin on Mon Mar 31 20:09:31 GMT 2025
PRIMARY
PUBCHEM
19754
Created by admin on Mon Mar 31 20:09:31 GMT 2025 , Edited by admin on Mon Mar 31 20:09:31 GMT 2025
PRIMARY
EPA CompTox
DTXSID9073969
Created by admin on Mon Mar 31 20:09:31 GMT 2025 , Edited by admin on Mon Mar 31 20:09:31 GMT 2025
PRIMARY
ECHA (EC/EINECS)
223-403-5
Created by admin on Mon Mar 31 20:09:31 GMT 2025 , Edited by admin on Mon Mar 31 20:09:31 GMT 2025
PRIMARY