Chemical Properties of Butanenitrile, 4-(methylthio)- (CAS 59121-24-3)

Butanenitrile, 4-(methylthio)-

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InChI
InChI=1S/C5H9NS/c1-7-5-3-2-4-6/h2-3,5H2,1H3
InChI Key
JPWPMBYFDCHLKL-UHFFFAOYSA-N
Formula
C5H9NS
SMILES
CSCCCC#N
Molecular Weight1
115.20
CAS
59121-24-3
Other Names
  • 3-(Methylthio)propyl cyanide
  • 4-Methylthio butanenitrile
  • 4-Methylthiobutyl nitrile
Sources

Physical Properties

Property Value Unit Source
Δf 157.52 kJ/mol Joback Calculated Property
Δfgas 60.22 kJ/mol Joback Calculated Property
Δfus 14.34 kJ/mol Joback Calculated Property
Δvap 44.02 kJ/mol Joback Calculated Property
logPoct/wat 1.65 Crippen Calculated Property
Pc 3435.91 kPa Joback Calculated Property
Tboil 484.66 K Joback Calculated Property
Tc 698.19 K Joback Calculated Property
Tfus 245.50 K Joback Calculated Property
Vc 0.40 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 192.75 J/mol×K 484.66 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-CN 1
-CH2- 3
-CH3 1
-S- 1

Similar Compounds

Pentanenitrile, 5-(methylthio)-. Butane, 1-(methylthio)-. 4-(Methylsulfinyl)butanenitrile. 1-Cyano-2,3-epithiopropane. 1-cyano-3,4-epithiobutane. 1-Butanethiol, 4-(methylthio)-. 6-(Methylthio)hexanenitrile. Thiocyanic acid, butyl ester. Butane, 1-(ethylthio)-. Pentane, 1-(methylthio)-. Butane, 1,4-bis(methylthio)-. 7-Methylthioheptanenitrile. Thiophene, tetrahydro-. Butane, 3-methyl-1-(methylthio)-. Butane, 1-(propylthio)-.

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