Chemical Properties of 2-Octane isothiocyanate (CAS 69626-80-8)

2-Octane isothiocyanate

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InChI
InChI=1S/C9H17NS/c1-3-4-5-6-7-9(2)10-8-11/h9H,3-7H2,1-2H3
InChI Key
RXAAZXUXIQEORL-UHFFFAOYSA-N
Formula
C9H17NS
SMILES
CCCCCCC(C)N=C=S
Molecular Weight1
171.30
CAS
69626-80-8
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Physical Properties

Property Value Unit Source
Δfgas 49.70 kJ/mol Joback Calculated Property
Δvap 45.68 kJ/mol Joback Calculated Property
log10WS -3.63 Crippen Calculated Property
logPoct/wat 3.448 Crippen Calculated Property
McVol 155.400 ml/mol McGowan Calculated Property
Pc 2374.90 kPa Joback Calculated Property
Tboil 550.83 K Joback Calculated Property
Tc 760.02 K Joback Calculated Property

Similar Compounds

2-Heptane isothiocyanate. 2-Hexane isothiocyanate. 3-Heptyl isothiocyanate. Cyclododecyl isothiocyanate. Cyclohexane, isothiocyanato-. 2-Pentane isothiocyanate. Cyclopentyl isothiocyanate. Cyclohexane, isocyanato-. Dicyclohexylcarbodiimide. Decyl isothiocyanate. Nonyl isothiocyanate. Dodecyl isothiocyanate. Undecyl isothiocyanate. Tetradecyl isothiocyanate. Octane, 1-isothiocyanato-.

Find more compounds similar to 2-Octane isothiocyanate.

Sources

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