Chemical Properties of «alpha»-Bisabolone oxide A

«alpha»-Bisabolone oxide A

PDF Excel Molecule Calculator
InChI
InChI=1S/C15H26O2/c1-11-5-7-12(8-6-11)15(4)10-9-13(16)14(2,3)17-15/h5,12-13,16H,6-10H2,1-4H3/t12?,13-,15+/m1/s1
InChI Key
WJHRAVIQWFQMKF-RLSDIYDTSA-N
Formula
C15H26O2
SMILES
CC1=CCC(C2(C)CCC(O)C(C)(C)O2)CC1
Molecular Weight1
238.37
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 -104.69 kJ/mol Joback Calculated Property
Δfgas -492.41 kJ/mol Joback Calculated Property
Δfus 20.72 kJ/mol Joback Calculated Property
Δvap 69.06 kJ/mol Joback Calculated Property
log10WS -4.19 Crippen Calculated Property
logPoct/wat 3.441 Crippen Calculated Property
McVol 207.930 ml/mol McGowan Calculated Property
Pc 2224.99 kPa Joback Calculated Property
Inp [1669.00; 1685.00]   Show Hide
Inp 1685.00 NIST
Inp 1669.00 NIST
Inp 1673.00 NIST
Inp 1685.00 NIST
Tboil 696.11 K Joback Calculated Property
Tc 915.11 K Joback Calculated Property
Tfus 413.56 K Joback Calculated Property
Vc 0.761 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [634.07; 750.18] J/mol×K [696.11; 915.11] Show Hide
Cp,gas 634.07 J/mol×K 696.11 Joback Calculated Property
Cp,gas 654.68 J/mol×K 732.61 Joback Calculated Property
Cp,gas 674.52 J/mol×K 769.11 Joback Calculated Property
Cp,gas 693.78 J/mol×K 805.61 Joback Calculated Property
Cp,gas 712.67 J/mol×K 842.11 Joback Calculated Property
Cp,gas 731.40 J/mol×K 878.61 Joback Calculated Property
Cp,gas 750.18 J/mol×K 915.11 Joback Calculated Property

Similar Compounds

«alpha»-Bisabolone oxide A. Bisabolol oxide. 2H-Pyran-3-ol, tetrahydro-2,2,6-trimethyl-6-(4-methyl-3-cyclohexen-1-yl)-, [3S-[3«alpha»,6«alpha»(R*)]]-. Bisabolol oxide B. 2-Furanmethanol, tetrahydro-«alpha»,«alpha»,5-trimethyl-5-(4-methyl-3-cyclohexen-1-yl)-, [2S-[2«alpha»,5«beta»(R*)]]-. Incensole. Isoincensole. Incensole. Incensole oxide. Shiromool. Sobrerol 8-acetate. Imcensole acetate. Isoincensole acetate. GA34, methyl ester. 11Beta,17alpha-dihydroxy-2beta,21-diacetoxypregn-4-ene-3,20-dione.

Find more compounds similar to «alpha»-Bisabolone oxide A.

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.