Chemical Properties of Italicen-12-yl acetate

Italicen-12-yl acetate

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InChI
InChI=1S/C17H26O2/c1-11-7-8-17-12(2)5-6-14(17)16(4,15(17)9-11)10-19-13(3)18/h9,12,14-15H,5-8,10H2,1-4H3/t12-,14+,15+,16+,17+/m1/s1
InChI Key
WEGYMQPVQUNDTQ-VFTHGPRRSA-N
Formula
C17H26O2
SMILES
CC(=O)OCC1(C)C2C=C(C)CCC23C(C)CCC13
Molecular Weight1
262.39
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Physical Properties

Property Value Unit Source
Δf 10.32 kJ/mol Joback Calculated Property
Δfgas -396.82 kJ/mol Joback Calculated Property
Δfus 23.16 kJ/mol Joback Calculated Property
Δvap 60.71 kJ/mol Joback Calculated Property
log10WS -4.13 Crippen Calculated Property
logPoct/wat 3.958 Crippen Calculated Property
McVol 220.950 ml/mol McGowan Calculated Property
Pc 1859.51 kPa Joback Calculated Property
Inp 1780.00 NIST
Tboil 688.69 K Joback Calculated Property
Tc 909.97 K Joback Calculated Property
Tfus 452.89 K Joback Calculated Property
Vc 0.847 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [668.83; 789.03] J/mol×K [688.69; 909.97] Show Hide
Cp,gas 668.83 J/mol×K 688.69 Joback Calculated Property
Cp,gas 689.94 J/mol×K 725.57 Joback Calculated Property
Cp,gas 710.27 J/mol×K 762.45 Joback Calculated Property
Cp,gas 730.07 J/mol×K 799.33 Joback Calculated Property
Cp,gas 749.63 J/mol×K 836.21 Joback Calculated Property
Cp,gas 769.19 J/mol×K 873.09 Joback Calculated Property
Cp,gas 789.03 J/mol×K 909.97 Joback Calculated Property

Similar Compounds

10-epi-Italicen-12-yl acetate. 10-epi-Italicen-12-yl isovalerate. Italicen-12-yl isovalerate. Italicen-12-yl isobutyrate. 10-epi-Italicen-12-yl isobutyrate. Italicen-12-yl 2-methylbutyrate. 10-epi-Italicen-12-yl 2-methylbutyrate. Cedr-8-en-13-yl, acetate. 12-Hydroxy-«beta»-caryophyllene acetate. ((1S,4aR,4bS,10aR)-1,4a-Dimethyl-7-(propan-2-ylidene)-1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydrophenanthren-1-yl)methyl acetate. 10-epi-Italicen-12-ol. Italicen-12-ol. Cedren-13-ol acetate. ((1S,4aR,4bR,10aR)-7-Isopropyl-1,4a-dimethyl-1,2,3,4,4a,4b,5,6,10,10a-decahydrophenanthren-1-yl)methyl acetate. (+)-12-Acetoxygymnomitr-3(15)-ene.

Find more compounds similar to Italicen-12-yl acetate.

Sources

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