Chemical Properties of Propane, 2-isothiocyanato-2-methyl- (CAS 590-42-1)

Propane, 2-isothiocyanato-2-methyl-

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InChI
InChI=1S/C5H9NS/c1-5(2,3)6-4-7/h1-3H3
InChI Key
ZFWFRTVIIMTOLY-UHFFFAOYSA-N
Formula
C5H9NS
SMILES
CC(C)(C)N=C=S
Molecular Weight1
115.20
CAS
590-42-1
Other Names
  • tert-Butyl Isothiocyanate
  • Isothiocyanic acid, tert-butyl ester
  • t-Butyl isothiocyanate
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Physical Properties

Property Value Unit Source
Δfgas 128.79 kJ/mol Joback Calculated Property
Δvap 35.87 kJ/mol Joback Calculated Property
IE 9.06 eV NIST
log10WS -1.96 Crippen Calculated Property
logPoct/wat 1.888 Crippen Calculated Property
McVol 99.040 ml/mol McGowan Calculated Property
Pc 3642.13 kPa Joback Calculated Property
Tboil 456.52 K Joback Calculated Property
Tc 689.64 K Joback Calculated Property

Similar Compounds

Propane, 2-isocyanato-2-methyl-. Carbodiimide, methyl tert.-butyl. Propane, 2-isocyano-2-methyl-. N-Ethylidene t-butylamine. 2-Propanamine, 2-methyl-. Isopropyl isothiocyanate. t-Butyldifluoroamine. N,N'-Di-t-butylethanedialdimine. 1,2-Bis(tert-butylimino)ethane. Diazene, bis(1,1-dimethylethyl)-. Propane, 2-methyl-2-nitro-. N'-tert-Butyl-N,N-dimethylformamidine. Nitroxide, bis(1,1-dimethylethyl). 3-Butyn-2-amine, 2-methyl-. 2-Propanamine, N,N,2-trimethyl-.

Find more compounds similar to Propane, 2-isothiocyanato-2-methyl-.

Sources

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