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Details

Stereochemistry ACHIRAL
Molecular Formula C8H18S
Molecular Weight 146.294
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIBUTYL SULFIDE

SMILES

CCCCSCCCC

InChI

InChIKey=HTIRHQRTDBPHNZ-UHFFFAOYSA-N
InChI=1S/C8H18S/c1-3-5-7-9-8-6-4-2/h3-8H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C8H18S
Molecular Weight 146.294
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Experimental and theoretical studies of the reaction of the OH radical with alkyl sulfides: 3. Kinetics and mechanism of the OH initiated oxidation of dimethyl, dipropyl, and dibutyl sulfides: reactivity trends in the alkyl sulfides and development of a predictive expression for the reaction of OH with DMS.
2009-06-18
Rate of dibutylsulfide decomposition by ozonation and the O3/H2O2 advanced oxidation process.
2009-05-30
A quantitative single-molecule study of thioether molecular rotors.
2008-11-25
Effect of temperature and initial dibutyl sulfide concentration in chloroform on its oxidation rate by ozone.
2008-09-15
Dimethyl sulfide on Cu{111}: molecular self-assembly and submolecular resolution imaging.
2007-12
Adsorption, interaction, and manipulation of dibutyl sulfide on cu{111}.
2007-08
Identification of the reactive intermediates produced upon photolysis of p-azidoacetophenone and its tetrafluoro analogue in aqueous and organic solvents: implications for photoaffinity labeling.
2007-02-20
Aquasonolysis of thioethers.
2006-05
Photochemical relationships in Sacoglossan polypropionates.
2005-04
Photo-oxidation of di-n-butylsulfide by various electron transfer sensitizers in oxygenated acetonitrile.
2005-02
Electron transfer and singlet oxygen mechanisms in the photooxygenation of dibutyl sulfide and thioanisole in MeCN sensitized by N-methylquinolinium tetrafluoborate and 9,10-dicyanoanthracene. The probable involvement of a thiadioxirane intermediate in electron transfer photooxygenations.
2003-12-31
Volatile metabolites of higher plant crops as a photosynthesizing life support system component under temperature stress at different light intensities.
2003
Oxidation of sulfides and disulfides under electron transfer or singlet oxygen photosensitization using soluble or grafted sensitizers.
2002-05
Stand-off tissue-based biosensors for the detection of chemical warfare agents using photosynthetic fluorescence induction.
2001-09
Induction of histone acetylation in mouse erythroleukemia cells by some organosulfur compounds including allyl isothiocyanate.
2001-06-15
Patents

Patents

Substance Class Chemical
Created
by admin
on Mon Mar 31 18:56:51 GMT 2025
Edited
by admin
on Mon Mar 31 18:56:51 GMT 2025
Record UNII
3E3H471GA3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIBUTYL SULFIDE
Systematic Name English
N-BUTYL SULFIDE
MI  
Preferred Name English
BUTYL SULFIDE
FHFI  
Systematic Name English
BUTYL SULFIDE [FHFI]
Common Name English
BUTYL SULPHIDE
Systematic Name English
FEMA NO. 2215
Code English
BUTANE, 1,1'- THIOBIS-
Systematic Name English
NSC-8460
Code English
5- THIANONANE
Systematic Name English
BUTYL MONOSULFIDE
Common Name English
N-BUTYL SULFIDE [MI]
Common Name English
Classification Tree Code System Code
EPA PESTICIDE CODE 127401
Created by admin on Mon Mar 31 18:56:51 GMT 2025 , Edited by admin on Mon Mar 31 18:56:51 GMT 2025
CFR 21 CFR 172.515
Created by admin on Mon Mar 31 18:56:51 GMT 2025 , Edited by admin on Mon Mar 31 18:56:51 GMT 2025
JECFA EVALUATION BUTYL SULFIDE
Created by admin on Mon Mar 31 18:56:51 GMT 2025 , Edited by admin on Mon Mar 31 18:56:51 GMT 2025
Code System Code Type Description
PUBCHEM
11002
Created by admin on Mon Mar 31 18:56:51 GMT 2025 , Edited by admin on Mon Mar 31 18:56:51 GMT 2025
PRIMARY
CAS
544-40-1
Created by admin on Mon Mar 31 18:56:51 GMT 2025 , Edited by admin on Mon Mar 31 18:56:51 GMT 2025
PRIMARY
MERCK INDEX
m2863
Created by admin on Mon Mar 31 18:56:51 GMT 2025 , Edited by admin on Mon Mar 31 18:56:51 GMT 2025
PRIMARY Merck Index
NSC
8460
Created by admin on Mon Mar 31 18:56:51 GMT 2025 , Edited by admin on Mon Mar 31 18:56:51 GMT 2025
PRIMARY
ECHA (EC/EINECS)
208-870-5
Created by admin on Mon Mar 31 18:56:51 GMT 2025 , Edited by admin on Mon Mar 31 18:56:51 GMT 2025
PRIMARY
FDA UNII
3E3H471GA3
Created by admin on Mon Mar 31 18:56:51 GMT 2025 , Edited by admin on Mon Mar 31 18:56:51 GMT 2025
PRIMARY
JECFA MONOGRAPH
1096
Created by admin on Mon Mar 31 18:56:51 GMT 2025 , Edited by admin on Mon Mar 31 18:56:51 GMT 2025
PRIMARY
MESH
C034081
Created by admin on Mon Mar 31 18:56:51 GMT 2025 , Edited by admin on Mon Mar 31 18:56:51 GMT 2025
PRIMARY
EPA CompTox
DTXSID6022058
Created by admin on Mon Mar 31 18:56:51 GMT 2025 , Edited by admin on Mon Mar 31 18:56:51 GMT 2025
PRIMARY