Chemical Properties of Caryophylladienol II (CAS 19431-79-9)

Caryophylladienol II

PDF Excel Molecule Calculator
InChI
InChI=1S/C15H24O/c1-10-6-8-14(16)11(2)5-7-13-12(10)9-15(13,3)4/h12-14,16H,1-2,5-9H2,3-4H3
InChI Key
CIIYOYPOMGIECX-UHFFFAOYSA-N
Formula
C15H24O
SMILES
C=C1CCC2C(CC2(C)C)C(=C)CCC1O
Molecular Weight1
220.35
CAS
19431-79-9
Other Names
  • Caryophylla-4(14),8(15)-dien-5«alpha»-ol
  • Caryophylla-2(12),6(13)-dien-5-«alpha»-ol
  • Caryophylla-4(14),8(15)-dien-5a-ol
  • Caryophylla-2(12),6(13)-dien-5 «alpha»-ol (caryophylladienol II)
  • caryophylla-2(12),6(13)-dien-5«alpha»-ol (= caryophylladienol II)
  • Caryophylla-4(14),8(15)-dien-5«alpha»-ol (=Caryophylladienol II)
  • «alpha»-Caryophylla-4(14),8(15)-dien-5-ol
  • Caryophylla-2(12),6(13)-dien-5 a-ol (Caryophylladienol II)
  • Caryophyll«alpha»-2(12),6(13)-dien-5- «alpha»-ol (=Caryophylladienol-II)
  • 5-«alpha»-Hydroxycaryophylla-4(12),8(13)-diene
  • Caryophyll«alpha»-2(12)-6(13)-dien-5«alpha»-ol
  • caryophylladienol II (caryophylla-2(12),6(13)-dien-5 -ol)
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
Δf 84.85 kJ/mol Joback Calculated Property
Δfgas -247.32 kJ/mol Joback Calculated Property
Δfus 17.99 kJ/mol Joback Calculated Property
Δvap 64.90 kJ/mol Joback Calculated Property
log10WS -4.25 Crippen Calculated Property
logPoct/wat 3.696 Crippen Calculated Property
McVol 197.760 ml/mol McGowan Calculated Property
Pc 2135.43 kPa Joback Calculated Property
Inp [1602.00; 1678.00]   Show Hide
Inp 1631.00 NIST
Inp 1641.00 NIST
Inp 1624.00 NIST
Inp 1637.00 NIST
Inp 1627.00 NIST
Inp 1623.00 NIST
Inp 1639.00 NIST
Inp 1622.00 NIST
Inp 1640.20 NIST
Inp 1637.00 NIST
Inp 1631.00 NIST
Inp 1627.00 NIST
Inp Outlier 1678.00 NIST
Inp 1656.00 NIST
Inp 1643.00 NIST
Inp 1615.00 NIST
Inp 1630.00 NIST
Inp 1638.00 NIST
Inp 1628.00 NIST
Inp Outlier 1602.00 NIST
Inp 1611.00 NIST
Inp 1635.00 NIST
Inp 1622.00 NIST
Inp 1622.00 NIST
Inp 1627.00 NIST
Inp 1641.00 NIST
Inp 1641.00 NIST
Inp 1634.00 NIST
Inp 1641.00 NIST
Inp Outlier 1604.00 NIST
Inp 1635.00 NIST
Inp 1641.00 NIST
Inp 1632.00 NIST
Inp 1641.00 NIST
Inp 1628.00 NIST
Inp 1623.00 NIST
Inp 1641.00 NIST
Inp 1624.00 NIST
Inp 1622.00 NIST
Inp 1631.00 NIST
I [2285.00; 2336.00]   Show Hide
I Outlier 2294.00 NIST
I Outlier 2287.00 NIST
I 2302.00 NIST
I Outlier 2285.00 NIST
I Outlier 2294.00 NIST
I 2324.00 NIST
I 2336.00 NIST
I 2316.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2324.00 NIST
I 2316.00 NIST
I 2316.00 NIST
I 2316.00 NIST
I 2320.00 NIST
Tboil 658.83 K Joback Calculated Property
Tc 866.81 K Joback Calculated Property
Tfus 380.69 K Joback Calculated Property
Vc 0.733 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [575.21; 680.34] J/mol×K [658.83; 866.81] Show Hide
Cp,gas 575.21 J/mol×K 658.83 Joback Calculated Property
Cp,gas 594.89 J/mol×K 693.49 Joback Calculated Property
Cp,gas 613.57 J/mol×K 728.16 Joback Calculated Property
Cp,gas 631.35 J/mol×K 762.82 Joback Calculated Property
Cp,gas 648.34 J/mol×K 797.48 Joback Calculated Property
Cp,gas 664.64 J/mol×K 832.14 Joback Calculated Property
Cp,gas 680.34 J/mol×K 866.81 Joback Calculated Property

Similar Compounds

Caryophylla-4,8-dien-5-ol. Exo methylene isomer of Caryophyllenol I. Caryophylla-2(12),6(13)-dien-5-ol. Caryophylla-4(12),8(13)-dien-5-ol. 10,10-Dimethyl-2,6-dimethylenebicyclo[7.2.0]undecan-5«beta»-ol. Cariophylladienol I. Caryophylladienol I. Caryophylla-3(15),7(14)-dien-6«alpha»-ol. 11,11-Dimethyl-4,8-dimethylenebicyclo[7.2.0]undecan-3-ol. 4-epi-Marsupellol. Pinocarveol, cis. trans-Isopinocarveol. Isopinocarveol. (E)-Pinocarveol. Bicyclo[3.1.1]heptan-3-ol, 6,6-dimethyl-2-methylene-.

Find more compounds similar to Caryophylladienol II.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Outlier This icon means that the value is more than 2 standard deviations away from the property mean.