Chemical Properties of trans-«beta»-Bergamotene (CAS 15438-94-5)

trans-«beta»-Bergamotene

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InChI
InChI=1S/C15H24/c1-11(2)6-5-9-15(4)13-8-7-12(3)14(15)10-13/h6,13-14H,3,5,7-10H2,1-2,4H3
InChI Key
DGZBGCMPRYFWFF-UHFFFAOYSA-N
Formula
C15H24
SMILES
C=C1CCC2CC1C2(C)CCC=C(C)C
Molecular Weight1
204.35
CAS
15438-94-5
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Physical Properties

Property Value Unit Source
Δf 296.37 kJ/mol Joback Calculated Property
Δfgas -26.92 kJ/mol Joback Calculated Property
Δfus 21.28 kJ/mol Joback Calculated Property
Δvap 47.72 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 1915.26 kPa Joback Calculated Property
Inp [1475.00; 1493.20]   Show Hide
Inp 1490.60 NIST
Inp 1493.20 NIST
Inp 1480.00 NIST
Inp 1475.00 NIST
Inp 1480.00 NIST
Tboil 559.12 K Joback Calculated Property
Tc 765.28 K Joback Calculated Property
Tfus 305.47 K Joback Calculated Property
Vc 0.744 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [495.48; 603.56] J/mol×K [559.12; 765.28] Show Hide
Cp,gas 495.48 J/mol×K 559.12 Joback Calculated Property
Cp,gas 516.19 J/mol×K 593.48 Joback Calculated Property
Cp,gas 535.61 J/mol×K 627.84 Joback Calculated Property
Cp,gas 553.91 J/mol×K 662.20 Joback Calculated Property
Cp,gas 571.23 J/mol×K 696.56 Joback Calculated Property
Cp,gas 587.73 J/mol×K 730.92 Joback Calculated Property
Cp,gas 603.56 J/mol×K 765.28 Joback Calculated Property

Similar Compounds

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

Find more compounds similar to trans-«beta»-Bergamotene.

Sources

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