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628-29-5

Basic Information
CAS No.: 628-29-5
Name: N-BUTYL METHYL SULFIDE
Article Data: 34
Molecular Structure:
Molecular Structure of 628-29-5 (N-BUTYL METHYL SULFIDE)
Formula: C5H12S
Molecular Weight: 104.216
Synonyms: Sulfide,butyl methyl (6CI,7CI,8CI);1-(Methylthio)butane;2-Thiahexane;Butyl methylsulfide;Butyl methyl thioether;Methyl butyl sulfide;n-Butyl methyl sulfide;a-(Methylthio)butane;
EINECS: 211-034-2
Density: 0.85 g/cm3
Melting Point: -97.85°C
Boiling Point: 122.6 °C at 760 mmHg
Flash Point: 20.6 °C
Hazard Symbols: R11:Highly flammable.;
Risk Codes: 11
Safety: 16-23-33
PSA: 25.30000
LogP: 2.14950
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  • 628-29-5       C5H12S           N-BUTYL METHYL SULFIDE

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    N-BUTYL METHYL SULFIDE Basic information Product Name: N-BUTYL METHYL SULFIDE Synonyms: N-BUTYL METHYL SULFIDE;N-BUTYL METHYL SULPHIDE;1-(Methylsulfanyl)butane;1-(m

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Specification

The IUPAC name of n-Butyl methyl sulphide is 1-methylsulfanylbutane . With the CAS registry number 628-29-5, it is also named as Butane, 1-(methylthio)- ; Methyl butyl sulphide ; Butyl methyl sulphide . n-Butyl methyl sulphide is highly flammable. Keep away from sources of ignition. Do not breathe vapour. Take precautionary measures against static discharges.

Many organic reaction can generate n-Butyl methyl sulphide . Such as: 1. 4-chloro-benzoic acid methyl ester can recats with tris-methylsulfanyl-methane to get tetrathioorthocarbonic acid tetramethyl ester , 1-(4-chloro-phenyl)-2,2-bis-methylsulfanyl-ethanone and 1-methylsulfanyl-butane . 2. 1-methyl-tetrahydro-thiophenium can generate methane , 1-methylsulfanyl-butane and tetrahydrothiophene .

The n-Butyl methyl sulphide can be used in organic synthesis to obtain other chemicals. For example: 1. It can react with azidobenzene to get 2-butylsulfanyl-aniline.

2. It also reacts with benzenesulfonic acid to get N-Phenylsulfonyl-S-butyl-S-methylsulfilimine .

The other characteristics of this product can be summarized as: (1)#Freely Rotating Bonds: 3 ; (2)Index of Refraction: 1.443 ; (3)Molar Refractivity: 33.21 cm3 ; (4)Molar Volume: 125 cm3 ; (5)Polarizability: 13.16×10-24 cm3 ; (6)Surface Tension: 25.7 dyne/cm ; (7)Enthalpy of Vaporization: 34.57 kJ/mol ; (8)Vapour Pressure: 16.6 mmHg at 25°C. People can use the following data to convert to the molecule structure. SMILES: S(CCCC)C; InChI: InChI=1/C5H12S/c1-3-4-5-6-2/h3-5H2,1-2H3.