Chemical Properties of Phenyl propargyl sulfide (CAS 5651-88-7)

Phenyl propargyl sulfide

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InChI
InChI=1S/C9H8S/c1-2-8-10-9-6-4-3-5-7-9/h1,3-7H,8H2
InChI Key
HXKVNRKJSSHQQY-UHFFFAOYSA-N
Formula
C9H8S
SMILES
C#CCSc1ccccc1
Molecular Weight1
148.23
CAS
5651-88-7
Other Names
  • Phenyl propargyl sulphide
Sources

Physical Properties

Property Value Unit Source
Δf 393.50 kJ/mol Joback Calculated Property
Δfgas 341.21 kJ/mol Joback Calculated Property
Δfus 20.21 kJ/mol Joback Calculated Property
Δvap 44.58 kJ/mol Joback Calculated Property
logPoct/wat 2.41 Crippen Calculated Property
Pc 3975.52 kPa Joback Calculated Property
Tboil 490.90 K Joback Calculated Property
Tc 740.00 K Joback Calculated Property
Tfus 298.98 K Joback Calculated Property
Vc 0.45 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 232.36 J/mol×K 490.9 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
=CH- (ring) 5
-S- 1
#C- 1
=C< (ring) 1
-CH2- 1
#CH 1

Similar Compounds

Benzene, (ethylthio)-. Sulfide, isopropyl phenyl. 2-(Phenylthio)ethanol. Benzene, (propylthio)-. Allylphenyl sulfide. Benzene, [(2-methylpropyl)thio]-. 1,2-Bis(phenylthio)ethane. Benzene, [(1,1-dimethylethyl)thio]-. Butylthiobenzene. Benzene, (methylthio)-. trans-1-(Phenylthio)-2-butene. Benzene, (2-butenylthio)-, (Z)-. Ethanethioic acid, s-phenyl ester. Cyclopropyl phenyl sulphide. Benzene, [(1-methylpropyl)thio]-.

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