Chemical Properties of Pentane, 2-isothiocyanato-2,4,4-trimethyl- (CAS 17701-76-7)

Pentane, 2-isothiocyanato-2,4,4-trimethyl-

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InChI
InChI=1S/C9H17NS/c1-8(2,3)6-9(4,5)10-7-11/h6H2,1-5H3
InChI Key
KUGHMFIBHMZICO-UHFFFAOYSA-N
Formula
C9H17NS
SMILES
CC(C)(C)CC(C)(C)N=C=S
Molecular Weight1
171.30
CAS
17701-76-7
Other Names
  • tert-Octyl isothiocyanate
  • 1,1,3,3-tetramethylbutyl isothiocyanate
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Physical Properties

Property Value Unit Source
ΔfH°gas 37.48 kJ/mol Joback Calculated Property
ΔvapH° 43.48 kJ/mol Joback Calculated Property
log10WS -3.39 Crippen Calculated Property
logPoct/wat 3.304 Crippen Calculated Property
McVol 155.400 ml/mol McGowan Calculated Property
Pc 2445.89 kPa Joback Calculated Property
Tboil 544.81 K Joback Calculated Property
Tc 776.74 K Joback Calculated Property

Similar Compounds

Acetamide, N-(1,1,3,3-tetramethylbutyl)-. 2-Pentanamine, 2,4,4-trimethyl-. Tert-butyl-(1,1,3,3-tetra-methylbutyl)diazene. Pentane, 2,2,4-trimethyl-4-nitro-. 2-Pentane isothiocyanate. N-tert-Octylacrylamide. 2-Hexane isothiocyanate. (4,6-Dichloro-[1,3,5]triazin-2-yl)-(1,1,3,3-tetramethyl-butyl)-amine. Pentane, 2,4-dimethyl-2-nitro-. Memantine. 2-Pentanone, 4-amino-4-methyl-. 2-Octane isothiocyanate. 2-Heptane isothiocyanate. Acetoacetamide, n-(1,1,3,3-tetramethylbutyl)-. 3-(t-Octylamino)propionitrile.

Find more compounds similar to Pentane, 2-isothiocyanato-2,4,4-trimethyl-.

Sources

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