Chemical Properties of (3S,3aS,6R,7R,9aS)-1,1,7-Trimethyldecahydro-3a,7-methanocyclopenta[8]annulene-3,6-diol (CAS 2649-64-1)

(3S,3aS,6R,7R,9aS)-1,1,7-Trimethyldecahydro-3a,7-methanocyclopenta[8]annulene-3,6-diol

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InChI
InChI=1S/C15H26O2/c1-13(2)8-12(17)15-7-5-11(16)14(3,9-15)6-4-10(13)15/h10-12,16-17H,4-9H2,1-3H3
InChI Key
BWXJQHJHGMZLBT-UHFFFAOYSA-N
Formula
C15H26O2
SMILES
CC1(C)CC(O)C23CCC(O)C(C)(CCC12)C3
Molecular Weight1
238.37
CAS
2649-64-1
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Physical Properties

Property Value Unit Source
Δf -91.87 kJ/mol Joback Calculated Property
Δfgas -472.77 kJ/mol Joback Calculated Property
Δfus 15.21 kJ/mol Joback Calculated Property
Δvap 78.22 kJ/mol Joback Calculated Property
log10WS -3.57 Crippen Calculated Property
logPoct/wat 2.725 Crippen Calculated Property
McVol 201.370 ml/mol McGowan Calculated Property
Pc 2568.89 kPa Joback Calculated Property
Inp [1885.20; 1885.20]   Show Hide
Inp 1885.20 NIST
Inp 1885.20 NIST
Tboil 746.70 K Joback Calculated Property
Tc 953.16 K Joback Calculated Property
Tfus 482.69 K Joback Calculated Property
Vc 0.751 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [667.30; 785.05] J/mol×K [746.70; 953.16] Show Hide
Cp,gas 667.30 J/mol×K 746.70 Joback Calculated Property
Cp,gas 685.84 J/mol×K 781.11 Joback Calculated Property
Cp,gas 704.43 J/mol×K 815.52 Joback Calculated Property
Cp,gas 723.35 J/mol×K 849.93 Joback Calculated Property
Cp,gas 742.89 J/mol×K 884.34 Joback Calculated Property
Cp,gas 763.36 J/mol×K 918.75 Joback Calculated Property
Cp,gas 785.05 J/mol×K 953.16 Joback Calculated Property

Similar Compounds

4,4,8-Trimethyltricyclo[6.3.1.0(1,5)]dodecane-2,9-diol. Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, (1S-endo)-. Isoborneol. (+)-Borneol. epi-Borneol. Borneol. Androstane-3,17-diol, (3«alpha»,5«alpha»,17«beta»)-. Androstane-3,17-diol, (3«alpha»,5«beta»,17«beta»)-. Androstane-3,17-diol, (3«beta»,5«alpha»,17«beta»)-. 5B-Estran-3A,17B-diol. Bicyclo[2.2.1]heptan-2-ol, 1,5,5-trimethyl-. Cholestan-3-ol, 4,4-dimethyl-, (3«beta»,5«alpha»)-. 4,4,14-«alpha»-Trimethyl-5-«alpha»-cholestan-3-«beta»-ol. Clovenol. Khusian-2-ol.

Find more compounds similar to (3S,3aS,6R,7R,9aS)-1,1,7-Trimethyldecahydro-3a,7-methanocyclopenta[8]annulene-3,6-diol.

Sources

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