Chemical Properties of (3S,3aR,6R,8aS)-7,7-Dimethyl-8-methyleneoctahydro-1H-3a,6-methanoazulene-3-carbaldehyde (CAS 82509-29-3)

(3S,3aR,6R,8aS)-7,7-Dimethyl-8-methyleneoctahydro-1H-3a,6-methanoazulene-3-carbaldehyde

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InChI
InChI=1S/C15H22O/c1-10-13-5-4-12(9-16)15(13)7-6-11(8-15)14(10,2)3/h9,11-13H,1,4-8H2,2-3H3
InChI Key
ONCLDGVLVUPPIN-UHFFFAOYSA-N
Formula
C15H22O
SMILES
C=C1C2CCC(C=O)C23CCC(C3)C1(C)C
Molecular Weight1
218.33
CAS
82509-29-3
Other Names
  • 1H-3a,6-Methanoazulene-3-carboxaldehyde, octahydro-7,7-dimethyl-8-methylene-, (3S,3aR,6R,8aS)-
  • 1H-3a,6-Methanoazulene-3-carboxaldehyde, octahydro-7,7-dimethyl-8-methylene-, [3S-(3«alpha»,3a«alpha»,6«alpha»,8a«alpha»)]-
  • Zizanal
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Physical Properties

Property Value Unit Source
Δf 160.63 kJ/mol Joback Calculated Property
Δfgas -158.39 kJ/mol Joback Calculated Property
Δfus 15.49 kJ/mol Joback Calculated Property
Δvap 53.03 kJ/mol Joback Calculated Property
log10WS -3.71 Crippen Calculated Property
logPoct/wat 3.594 Crippen Calculated Property
McVol 186.900 ml/mol McGowan Calculated Property
Pc 2265.42 kPa Joback Calculated Property
Inp [1645.00; 1691.00]   Show Hide
Inp 1689.00 NIST
Inp 1691.00 NIST
Inp 1680.00 NIST
Inp 1663.00 NIST
Inp 1649.00 NIST
Inp 1645.00 NIST
Inp 1680.00 NIST
Tboil 610.32 K Joback Calculated Property
Tc 836.85 K Joback Calculated Property
Tfus 400.59 K Joback Calculated Property
Vc 0.726 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [529.85; 641.24] J/mol×K [610.32; 836.85] Show Hide
Cp,gas 529.85 J/mol×K 610.32 Joback Calculated Property
Cp,gas 550.56 J/mol×K 648.07 Joback Calculated Property
Cp,gas 570.01 J/mol×K 685.83 Joback Calculated Property
Cp,gas 588.51 J/mol×K 723.58 Joback Calculated Property
Cp,gas 606.35 J/mol×K 761.34 Joback Calculated Property
Cp,gas 623.83 J/mol×K 799.09 Joback Calculated Property
Cp,gas 641.24 J/mol×K 836.85 Joback Calculated Property

Similar Compounds

3-((1R,2S,4S)-2-Methyl-3-methylenebicyclo[2.2.1]heptan-2-yl)propanal. 12-nor-Preziza-7(15)-en-2-one. Ziza-6(13)-en-3-one. 2-epi-Ziza-6(13)-en-3-one. (3S,3aR,6R,8aS)-3,7,7-Trimethyl-8-methylenehexahydro-1H-3a,6-methanoazulen-2(3H)-one. Khusimone. (3aR,6R,8aR)-7,7-Dimethyl-8-methylenehexahydro-1H-3a,6-methanoazulen-3(2H)-one. «gamma»-Campholenic aldehyde. Elema-1,11-dien-15-al, epimer a. Elema-1,11-dien-15-al. Elema-1,11-dien-15-al, epimer b. 6-Camphenone. 19-Oxo-ent-kaur-16-ene. ent-Kaurenal. (-)-Kaur-16-en-19-al.

Find more compounds similar to (3S,3aR,6R,8aS)-7,7-Dimethyl-8-methyleneoctahydro-1H-3a,6-methanoazulene-3-carbaldehyde.

Sources

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