Chemical Properties of (-)-Marsupellol acetate

(-)-Marsupellol acetate

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InChI
InChI=1S/C17H26O2/c1-10-13(19-11(2)18)9-12-15-14(10)17(12,5)8-6-7-16(15,3)4/h12-15H,1,6-9H2,2-5H3/t12?,13-,14?,15?,17?/m1/s1
InChI Key
RCEFXIVQCAIFDV-MVGVAPMGSA-N
Formula
C17H26O2
SMILES
C=C1C(OC(C)=O)CC2C3C1C2(C)CCCC3(C)C
Molecular Weight1
262.39
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Physical Properties

Property Value Unit Source
Δf 35.36 kJ/mol Joback Calculated Property
Δfgas -379.23 kJ/mol Joback Calculated Property
Δfus 22.24 kJ/mol Joback Calculated Property
Δvap 59.60 kJ/mol Joback Calculated Property
log10WS -4.24 Crippen Calculated Property
logPoct/wat 3.957 Crippen Calculated Property
McVol 220.950 ml/mol McGowan Calculated Property
Pc 1804.63 kPa Joback Calculated Property
Inp [1673.00; 1673.00]   Show Hide
Inp 1673.00 NIST
Inp 1673.00 NIST
Inp 1673.00 NIST
Tboil 679.04 K Joback Calculated Property
Tc 899.33 K Joback Calculated Property
Tfus 449.05 K Joback Calculated Property
Vc 0.844 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [669.85; 792.19] J/mol×K [679.04; 899.33] Show Hide
Cp,gas 669.85 J/mol×K 679.04 Joback Calculated Property
Cp,gas 691.60 J/mol×K 715.75 Joback Calculated Property
Cp,gas 712.47 J/mol×K 752.47 Joback Calculated Property
Cp,gas 732.71 J/mol×K 789.18 Joback Calculated Property
Cp,gas 752.57 J/mol×K 825.90 Joback Calculated Property
Cp,gas 772.32 J/mol×K 862.61 Joback Calculated Property
Cp,gas 792.19 J/mol×K 899.33 Joback Calculated Property

Similar Compounds

Marsupellyl acetate. (-)-4-epi-Marsupellol acetate. (-)-4-epi-Marsupellyl acetate. Pinocarvyl acetate. (Z)-Pinocarvyl acetate. trans-Pinocarvyl acetate. trans-Pinocarvyl laureate. trans-Pinocarvyl caprate. Cedrenol acetate. 8(15)-Cedren-9-«alpha»-yl acetate. (-)-9-Acetoxygymnomitr-8(12)-ene. 4«beta»-Acetoxygymnomitr-3(15)-ene. trans-Pinocarvyl formate. (1S,3S,5S)-1-Isopropyl-4-methylenebicyclo[3.1.0]hexan-3-yl acetate. cis-Sabinyl acetate.

Find more compounds similar to (-)-Marsupellol acetate.

Sources

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