Chemical Properties of «beta»-caryophyllene hydrate

«beta»-caryophyllene hydrate

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InChI
InChI=1S/C15H26O/c1-11-6-5-8-15(4,16)9-7-13-12(11)10-14(13,2)3/h12-13,16H,1,5-10H2,2-4H3
InChI Key
KTBROVRYPKGILD-UHFFFAOYSA-N
Formula
C15H26O
SMILES
C=C1CCCC(C)(O)CCC2C1CC2(C)C
Molecular Weight1
222.37
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Physical Properties

Property Value Unit Source
Δf 26.28 kJ/mol Joback Calculated Property
Δfgas -316.32 kJ/mol Joback Calculated Property
Δfus 12.85 kJ/mol Joback Calculated Property
Δvap 63.59 kJ/mol Joback Calculated Property
log10WS -4.39 Crippen Calculated Property
logPoct/wat 3.920 Crippen Calculated Property
McVol 202.060 ml/mol McGowan Calculated Property
Pc 2187.68 kPa Joback Calculated Property
Inp [1553.00; 1553.00]   Show Hide
Inp 1553.00 NIST
Inp 1553.00 NIST
I 2021.00 NIST
Tboil 659.91 K Joback Calculated Property
Tc 873.53 K Joback Calculated Property
Tfus 390.91 K Joback Calculated Property
Vc 0.747 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [595.57; 709.81] J/mol×K [659.91; 873.53] Show Hide
Cp,gas 595.57 J/mol×K 659.91 Joback Calculated Property
Cp,gas 616.20 J/mol×K 695.51 Joback Calculated Property
Cp,gas 635.93 J/mol×K 731.12 Joback Calculated Property
Cp,gas 654.95 J/mol×K 766.72 Joback Calculated Property
Cp,gas 673.48 J/mol×K 802.32 Joback Calculated Property
Cp,gas 691.70 J/mol×K 837.93 Joback Calculated Property
Cp,gas 709.81 J/mol×K 873.53 Joback Calculated Property

Similar Compounds

Zingiberol. 10-epi-«beta»-Eudesmol. 7-epi-«beta»-Eudesmol. 2-Naphthalenemethanol, decahydro-«alpha»,«alpha»,4a-trimethyl-8-methylene-, [2R-(2«alpha»,4a«alpha»,8a«beta»)]-. Bicyclovetivenol. 1-endo-Bourbonanol. 5-epi-Paradisol. Selin-11-en-4-«alpha»-ol. Paradisol. Intermedeol. Eudesm-11-en-4«beta»ol. «alpha»-Selina-11-en-4-ol. Selinen-4-ol. Paradisiol. 1-Naphthalenepropanol, «alpha»-ethenyldecahydro-«alpha»,5,5,8a-tetramethyl-2-methylene-, [1S-[1«alpha»(R*),4a«beta»,8a«alpha»]]-.

Find more compounds similar to «beta»-caryophyllene hydrate.

Sources

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