Chemical Properties of (+)(E)-Caryophyllene

(+)(E)-Caryophyllene

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InChI
InChI=1S/C15H24/c1-11-6-5-7-12(2)13-10-15(3,4)14(13)9-8-11/h6,13-14H,2,5,7-10H2,1,3-4H3/b11-6+
InChI Key
NPNUFJAVOOONJE-IZZDOVSWSA-N
Formula
C15H24
SMILES
C=C1CCC=C(C)CCC2C1CC2(C)C
Molecular Weight1
204.35
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Physical Properties

Property Value Unit Source
Δf 196.63 kJ/mol Joback Calculated Property
Δfgas -112.68 kJ/mol Joback Calculated Property
Δfus 14.82 kJ/mol Joback Calculated Property
Δvap 49.32 kJ/mol Joback Calculated Property
log10WS -4.87 Crippen Calculated Property
logPoct/wat 4.725 Crippen Calculated Property
McVol 191.890 ml/mol McGowan Calculated Property
Pc 2027.23 kPa Joback Calculated Property
Inp [1418.00; 1418.00]   Show Hide
Inp 1418.00 NIST
Inp 1418.00 NIST
I [1607.00; 1607.00]   Show Hide
I 1607.00 NIST
I 1607.00 NIST
Tboil 576.30 K Joback Calculated Property
Tc 802.06 K Joback Calculated Property
Tfus 323.71 K Joback Calculated Property
Vc 0.717 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [501.77; 624.31] J/mol×K [576.30; 802.06] Show Hide
Cp,gas 501.77 J/mol×K 576.30 Joback Calculated Property
Cp,gas 525.28 J/mol×K 613.93 Joback Calculated Property
Cp,gas 547.37 J/mol×K 651.55 Joback Calculated Property
Cp,gas 568.18 J/mol×K 689.18 Joback Calculated Property
Cp,gas 587.84 J/mol×K 726.81 Joback Calculated Property
Cp,gas 606.51 J/mol×K 764.43 Joback Calculated Property
Cp,gas 624.31 J/mol×K 802.06 Joback Calculated Property

Similar Compounds

Isocaryophyllene. Bicyclo[7.2.0]undec-4-ene, 4,11,11-trimethyl-8-methylene-,[1R-(1R*,4Z,9S*)]-. Bicyclo[7.2.0]undec-4-ene, 4,11,11-trimethyl-8-methylene-deriv.. (1R,9R,E)-4,11,11-Trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene. 9-epi-Caryophyllene. (E)-Caryophyllene. Caryophyllene. Bicyclo[7.2.0]undec-4-ene, 4,11,11-trimethyl-8-methylene-. 4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-3-ene. 1R,3Z,9s-4,11,11-Trimethyl-8-methylenebicyclo[7.2.0]undec-3-ene. Cumacrene. trans-«beta»-Bergamotene. «beta»-trans-Bergamotene. Bicyclo[3.1.1]heptane, 6-methyl-2-methylene-6-(4-methyl-3-pentenyl)-, [1R-(1«alpha»,5«alpha»,6«beta»)]-. «beta»-Bergamotene.

Find more compounds similar to (+)(E)-Caryophyllene.

Sources

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