Chemical Properties of 2-Cyanophenyl isothiocyanate (CAS 81431-98-3)

2-Cyanophenyl isothiocyanate

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InChI
InChI=1S/C8H4N2S/c9-5-7-3-1-2-4-8(7)10-6-11/h1-4H
InChI Key
GDHYPPBFBJXNRE-UHFFFAOYSA-N
Formula
C8H4N2S
SMILES
N#Cc1ccccc1N=C=S
Molecular Weight1
160.20
CAS
81431-98-3
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Physical Properties

Property Value Unit Source
Δfgas 465.56 kJ/mol Joback Calculated Property
Δvap 57.26 kJ/mol Joback Calculated Property
log10WS -2.74 Crippen Calculated Property
logPoct/wat 2.293 Crippen Calculated Property
McVol 118.930 ml/mol McGowan Calculated Property
Pc 3572.80 kPa Joback Calculated Property
Tboil 662.13 K Joback Calculated Property
Tc 936.65 K Joback Calculated Property

Similar Compounds

3-Cyanophenyl isothiocyanate. Benzene, 1-isothiocyanato-2-methyl-. Benzonitrile, 2-amino-. Benzonitrile, 2-nitro-. Benzene, 1-isocyanato-2-(trifluoromethyl)-. m-Tolyl isothiocyanate. Benzene, 1-isothiocyanato-3-(trifluoromethyl)-. Benzene, 1-isocyanato-2-methyl-. Benzonitrile, m-amino-. 2,4-Dimethylphenyl isothiocyanate. 2,5-Dimethylphenyl isothiocyanate. 2,3-Dimethylphenylisothiocyanate. Benzonitrile, 3-nitro-. Formamide, N-(2-methylphenyl)-. 5-Fluoro-2-methylphenyl isothiocyanate.

Find more compounds similar to 2-Cyanophenyl isothiocyanate.

Sources

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