Chemical Properties of 1H-3a,7-Methanoazulene, 2,3,6,7,8,8a-hexahydro-1,4,9,9-tetramethyl-, (1«alpha»,3a«alpha»,7«alpha»,8a«beta»)- (CAS 560-32-7)

1H-3a,7-Methanoazulene, 2,3,6,7,8,8a-hexahydro-1,4,9,9-tetramethyl-, (1«alpha»,3a«alpha»,7«alpha»,8a«beta»)-

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InChI
InChI=1S/C15H24/c1-10-7-8-15-11(2)5-6-12(9-13(10)15)14(15,3)4/h5,10,12-13H,6-9H2,1-4H3
InChI Key
KVQOADNSNSUAJT-UHFFFAOYSA-N
Formula
C15H24
SMILES
CC1=CCC2CC3C(C)CCC13C2(C)C
Molecular Weight1
204.35
CAS
560-32-7
Other Names
  • 1H-3a,7-Methanoazulene, 2,3,6,7,8,8a«alpha»-hexahydro-1«beta»,4,9,9-tetramethyl-
  • (1R,3aS,7S,8aR)-1,4,9,9-Tetramethyl-2,3,6,7,8,8a-hexahydro-1H-3a,7-methanoazulene
  • «alpha»-Patchoulene
  • 1H-3a,7-Methanoazulene, 2,3,6,7,8,8a-hexahydro-1,4,9,9-tetramethyl-, (1R,3aS,7S,8aR)-rel-

Physical Properties

Property Value Unit Source
Δf 227.40 kJ/mol Joback Calculated Property
Δfgas -110.74 kJ/mol Joback Calculated Property
Δfus 15.19 kJ/mol Joback Calculated Property
Δvap 47.10 kJ/mol Joback Calculated Property
log10WS -4.43 Crippen Calculated Property
logPoct/wat 4.415 Crippen Calculated Property
McVol 185.330 ml/mol McGowan Calculated Property
Pc 2117.78 kPa Joback Calculated Property
Inp [1443.00; 1486.00]   Show Hide
Inp 1456.00 NIST
Inp 1456.00 NIST
Inp 1444.00 NIST
Inp 1464.00 NIST
Inp 1445.00 NIST
Inp 1462.00 NIST
Inp 1457.00 NIST
Inp 1457.00 NIST
Inp 1456.00 NIST
Inp 1464.00 NIST
Inp 1450.00 NIST
Inp 1456.00 NIST
Inp 1450.00 NIST
Inp 1445.00 NIST
Inp 1461.00 NIST
Inp Outlier 1486.00 NIST
Inp 1462.00 NIST
Inp 1460.00 NIST
Inp 1452.00 NIST
Inp 1443.00 NIST
Inp Outlier 1486.00 NIST
Inp 1457.00 NIST
Inp 1463.00 NIST
Inp 1464.00 NIST
I [1640.00; 1658.00]   Show Hide
I 1640.00 NIST
I 1640.00 NIST
I 1658.00 NIST
Tboil 566.64 K Joback Calculated Property
Tc 792.17 K Joback Calculated Property
Tfus 358.19 K Joback Calculated Property
Vc 0.711 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [503.55; 623.74] J/mol×K [566.64; 792.17] Show Hide
Cp,gas 503.55 J/mol×K 566.64 Joback Calculated Property
Cp,gas 526.55 J/mol×K 604.23 Joback Calculated Property
Cp,gas 547.97 J/mol×K 641.82 Joback Calculated Property
Cp,gas 568.10 J/mol×K 679.41 Joback Calculated Property
Cp,gas 587.25 J/mol×K 716.99 Joback Calculated Property
Cp,gas 605.70 J/mol×K 754.58 Joback Calculated Property
Cp,gas 623.74 J/mol×K 792.17 Joback Calculated Property

Similar Compounds

«alpha»-Bisabolene. 1,3a-Ethano-3aH-indene, 1,2,3,6,7,7a-hexahydro-2,2,4,7a-tetramethyl-, [1R-(1«alpha»,3a«alpha»,7a«alpha»)]-. «alpha»-Neoclovene. «alpha»-Clovene. «delta»-patchoulene. 5-Androstene, 4,4-dimethyl-. Cholest-5-ene. 2,3A-ethanoindan, 3a,4,5,6-tetrahydro-1,1,4,4-tetramethyl-. 2H-2,4a-Methanonaphthalene, 1,3,4,5,6,7-hexahydro-1,1,5,5-tetramethyl-, (2S)-. Cyclobazzanene. «alpha»-Panasinsene. «alpha»-panasinsen. (-)-«alpha»-Panasinsen. Cholest-4-ene. 24-Norursa-3,12-diene.

Find more compounds similar to 1H-3a,7-Methanoazulene, 2,3,6,7,8,8a-hexahydro-1,4,9,9-tetramethyl-, (1«alpha»,3a«alpha»,7«alpha»,8a«beta»)-.

Sources

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.

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