Chemical Properties of (3S,3aR,6R,8aS)-3,7,7-Trimethyl-8-methylenehexahydro-1H-3a,6-methanoazulen-2(3H)-one (CAS 28624-27-3)

(3S,3aR,6R,8aS)-3,7,7-Trimethyl-8-methylenehexahydro-1H-3a,6-methanoazulen-2(3H)-one

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InChI
InChI=1S/C15H22O/c1-9-12-7-13(16)10(2)15(12)6-5-11(8-15)14(9,3)4/h10-12H,1,5-8H2,2-4H3
InChI Key
RVQOGXCBZWSGSS-UHFFFAOYSA-N
Formula
C15H22O
SMILES
C=C1C2CC(=O)C(C)C23CCC(C3)C1(C)C
Molecular Weight1
218.33
CAS
28624-27-3
Other Names
  • Epizizanone
  • 2-Epizizanone
  • 2-epi-Ziza-6(13)-en-3-one
  • Ziza-6(13)-en-3-one
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Physical Properties

Property Value Unit Source
Δf 137.56 kJ/mol Joback Calculated Property
Δfgas -210.51 kJ/mol Joback Calculated Property
Δfus 12.71 kJ/mol Joback Calculated Property
Δvap 50.55 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 2183.60 kPa Joback Calculated Property
Inp [1669.00; 1669.00]   Show Hide
Inp 1669.00 NIST
Inp 1669.00 NIST
Tboil 629.48 K Joback Calculated Property
Tc 866.95 K Joback Calculated Property
Tfus 426.81 K Joback Calculated Property
Vc 0.716 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [541.93; 662.38] J/mol×K [629.48; 866.95] Show Hide
Cp,gas 541.93 J/mol×K 629.48 Joback Calculated Property
Cp,gas 563.88 J/mol×K 669.06 Joback Calculated Property
Cp,gas 584.68 J/mol×K 708.64 Joback Calculated Property
Cp,gas 604.63 J/mol×K 748.22 Joback Calculated Property
Cp,gas 624.03 J/mol×K 787.79 Joback Calculated Property
Cp,gas 643.18 J/mol×K 827.37 Joback Calculated Property
Cp,gas 662.38 J/mol×K 866.95 Joback Calculated Property

Similar Compounds

Ziza-6(13)-en-3-one. 2-epi-Ziza-6(13)-en-3-one. 6-Camphenone. Khusimone. (3aR,6R,8aR)-7,7-Dimethyl-8-methylenehexahydro-1H-3a,6-methanoazulen-3(2H)-one. 12-nor-Preziza-7(15)-en-2-one. Camphenone, 6-. (3S,3aR,6R,8aS)-7,7-Dimethyl-8-methyleneoctahydro-1H-3a,6-methanoazulene-3-carbaldehyde. 2,3-dimethyl-4-isopropenyl-1-cyclopentanone. cis-Eudesm-4(15)-en-1-one. 4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undecan-5-one. 15-nor-Prezizaan-7-one. lsolongifolen-9-one. 4,6-diisopropylidene-8,8-dimethylbicyclo[5.1.0]-octan-2-one. Lup-20(29)-en-3-one.

Find more compounds similar to (3S,3aR,6R,8aS)-3,7,7-Trimethyl-8-methylenehexahydro-1H-3a,6-methanoazulen-2(3H)-one.

Sources

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