Chemical Properties of N-(2-octanoylmercapto) ethyloctanamide (CAS 116401-75-3)

N-(2-octanoylmercapto) ethyloctanamide

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InChI
InChI=1S/C18H35NO2S/c1-3-5-7-9-11-13-17(20)19-15-16-22-18(21)14-12-10-8-6-4-2/h3-16H2,1-2H3,(H,19,20)
InChI Key
VHRMFSXVENWLHR-UHFFFAOYSA-N
Formula
C18H35NO2S
SMILES
CCCCCCCC(=O)SCCN=C(O)CCCCCCC
Molecular Weight1
329.54
CAS
116401-75-3
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Physical Properties

Property Value Unit Source
ΔfH°gas -565.36 kJ/mol Joback Calculated Property
ΔvapH° 89.30 kJ/mol Joback Calculated Property
log10WS -6.00 Crippen Calculated Property
logPoct/wat 5.924 Crippen Calculated Property
McVol 293.950 ml/mol McGowan Calculated Property
Pc 1210.67 kPa Joback Calculated Property
Tboil 902.63 K Joback Calculated Property
Tc 1106.17 K Joback Calculated Property

Similar Compounds

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Sources

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