Dibutyl sulfide

Dibutyl sulfide
  • CAS No.:544-40-1
Other grades of this product :
Dibutyl sulfide Basic information
Description References
Product Name:Dibutyl sulfide
Synonyms:Butyl sulfide solution;Dibutyl sulfide >=98.0% (GC);BUTYLTHIOBUTANE;BUTYL SULFIDE;BUTYL SULPHIDE;'LGC' (4000);FEMA 2215;DIBUTYLTHIOETHER
CAS:544-40-1
MF:C8H18S
MW:146.29
EINECS:208-870-5
Product Categories:Building Blocks;Chemical Synthesis;sulfide Flavor;Organic Building Blocks;Sulfides/Disulfides;Sulfur Compounds
Mol File:544-40-1.mol
Dibutyl sulfide Chemical Properties
Melting point -76 °C (lit.)
Boiling point 188-189 °C (lit.)
density 0.838 g/mL at 25 °C (lit.)
vapor density 5.07 (vs air)
vapor pressure 5.17 mm Hg ( 37.7 °C)
refractive index n20/D 1.452(lit.)
FEMA 2215 | BUTYL SULFIDE
Fp 170 °F
storage temp. Store below +30°C.
form Liquid
color Clear colorless to very slightly yellow
Odor Threshold0.00051ppm
Water Solubility Silghtly miscible with water. Miscible with olive oil and almond oil.
JECFA Number455
Merck 14,1590
BRN 1732829
Stability:Stable. Combustible. Incompatible with strong oxidizing agents.
InChIKeyHTIRHQRTDBPHNZ-UHFFFAOYSA-N
CAS DataBase Reference544-40-1(CAS DataBase Reference)
NIST Chemistry ReferenceDi-n-butyl sulfide(544-40-1)
EPA Substance Registry SystemDibutyl sulfide (544-40-1)
Safety Information
Hazard Codes Xi
Risk Statements 36/37/38-41
Safety Statements 26-36/37/39-24/25-36
RIDADR 2810
WGK Germany 2
RTECS ER6417000
13
TSCA Yes
HazardClass 6.1(b)
PackingGroup III
HS Code 29309070
ToxicityLD50 orally in Rabbit: 2220 mg/kg
MSDS Information
ProviderLanguage
Butyl sulfide English
SigmaAldrich English
ACROS English
ALFA English
Dibutyl sulfide Usage And Synthesis
DescriptionDibutyl sulfide (also named as butyl sulfide; N-butyl sulfide; Di-n-butyl sulfide; butylthiobutane), a colorless to pale yellow clear liquid, is a symmetric thioether. Dibutyl sulfide is found in raw cabbage, boiled and cooked beef, and some varieties of mushroom. Dibutyl sulfide is typically used as a flavoring agent. As a thioether, dibutyl sulfide has applications in organic synthesis as a solvent as well as a reagent. It is used to synthesize specific compound classes including property-enhancing additives, pharmacological drugs, chemical resistant polymers, detergents, and rubber antioxidants. Dibutyl sulfide can also be used as an agricultural intermediate, a sulfiding agent, a refinery catalyst, a lubricant additive, a gas odorant, and a processing aid in mining applications. Furthermore, it can be used as an internal standard in X-ray fluorescence spectrometry (XRF) measurements of sulfur in oils and other liquid hydrocarbon matrices.
References[1] George A. Burdock (1996) Encyclopedia of Food and Color Additives, Band 1 [2] http://chemicalland21.com/specialtychem/NH/DIBUTYL%20SULFIDE.htm
Chemical Propertiescolourless liquid with a very unpleasant smell
Chemical PropertiesButyl sulfide has an herbaceous, green, garlic, onion, heavy odor.
OccurrenceReported found in raw cabbage, cooked beef and mushrooms.
UsesDi-n-butyl sulfide is generally used as an agricultural intermediate, a sulfiding agent, a refinery catalyst, a lubricant additive, a gas odorant and a processing aid in mining applications. It finds application as an internal standard in X-ray fluorescence spectrometry (XRF) measurements of sulfur in oils and other liquid hydrocarbon matrices.
PreparationFrom butyl bromide and sodium sulfide in boiling ethanol; according to some authors two forms exist, exhibiting different boiling points but identical solubilities in various solvents; both forms are insoluble in water.
Aroma threshold valuesRecognition: 0.88 ppb
Synthesis Reference(s)Journal of the American Chemical Society, 73, p. 2251, 1951 DOI: 10.1021/ja01149a096Tetrahedron Letters, 29, p. 4477, 1988 DOI: 10.1016/S0040-4039(00)80527-4
General DescriptionButyl sulfide is a volatile sulfur compound that can be used as a flavoring agent.
Biochem/physiol ActionsTaste at 5 ppm
Purification MethodsWash the sulfide with aqueous 5% NaOH, then water. Dry with CaCl2 and distil it from sodium. [Beilstein 1 IV 1559.]

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