Chemical Properties of Phenanthrene, 7-ethenyl-1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,1,4a,7-tetramethyl-, [4aS-(4a«alpha»,4b«beta»,7«beta»,10a«beta»)]- (CAS 1686-56-2)

Phenanthrene, 7-ethenyl-1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,1,4a,7-tetramethyl-, [4aS-(4a«alpha»,4b«beta»,7«beta»,10a«beta»)]-

InChI
InChI=1S/C20H32/c1-6-19(4)13-10-16-15(14-19)8-9-17-18(2,3)11-7-12-20(16,17)5/h6,14,16-17H,1,7-13H2,2-5H3/t16?,17?,19-,20-/m0/s1
InChI Key
XDSYKASBVOZOAG-WXDAQCLHSA-N
Formula
C20H32
SMILES
C=CC1(C)C=C2CCC3C(C)(C)CCCC3(C)C2CC1
Molecular Weight1
272.47
CAS
1686-56-2
Other Names
  • Podocarp-8(14)-ene, 13«beta»-methyl-13-vinyl-
  • Sandaracopimaradiene
  • 13-Isopimaradiene
  • 8(14),15-Sandaracopimaradiene
  • Sandaracopimara-8(14),15-diene
  • Pimara-8(14),15-diene
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Physical Properties

Property Value Unit Source
ΔfusH° 14.26 kJ/mol Joback Calculated Property
logPoct/wat 6.142 Crippen Calculated Property
McVol 251.480 ml/mol McGowan Calculated Property
Inp [1919.00; 1999.00]   Show Hide
Inp 1919.00 NIST
Inp 1936.00 NIST
Inp 1943.00 NIST
Inp 1969.00 NIST
Inp 1966.00 NIST
Inp 1960.00 NIST
Inp 1950.00 NIST
Inp 1961.00 NIST
Inp 1941.00 NIST
Inp 1961.00 NIST
Inp 1961.00 NIST
Inp 1960.00 NIST
Inp 1961.00 NIST
Inp 1941.00 NIST
Inp 1961.00 NIST
Inp 1931.00 NIST
Inp Outlier 1996.00 NIST
Inp 1969.00 NIST
Inp 1970.00 NIST
Inp 1941.00 NIST
Inp 1941.00 NIST
Inp 1943.00 NIST
Inp Outlier 1999.00 NIST
Inp 1942.00 NIST
Inp 1941.00 NIST
Inp 1942.00 NIST
Inp 1961.00 NIST
Inp 1967.00 NIST
Inp 1973.40 NIST
Inp 1965.00 NIST
Inp 1975.00 NIST
Inp 1955.00 NIST
Inp 1960.00 NIST
Inp 1941.00 NIST
Inp 1935.00 NIST
Inp 1922.00 NIST
Inp 1919.00 NIST
Inp 1941.00 NIST
Inp 1935.00 NIST
Inp 1941.00 NIST
Inp 1951.00 NIST
Inp 1969.00 NIST
Inp 1941.00 NIST
Inp 1946.00 NIST
Inp 1966.00 NIST
Inp 1961.00 NIST
Inp 1919.00 NIST
I [2229.00; 2287.00]   Show Hide
I 2243.00 NIST
I 2279.00 NIST
I 2255.00 NIST
I 2229.00 NIST
I 2287.00 NIST
I 2287.00 NIST
I 2287.00 NIST
I 2243.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [762.71; 920.40] J/mol×K [690.77; 930.20] Show Hide
Cp,gas 762.71 J/mol×K 690.77 Joback Calculated Property
Cp,gas 789.62 J/mol×K 730.67 Joback Calculated Property
Cp,gas 815.66 J/mol×K 770.58 Joback Calculated Property
Cp,gas 841.30 J/mol×K 810.48 Joback Calculated Property
Cp,gas 867.00 J/mol×K 850.39 Joback Calculated Property
Cp,gas 893.21 J/mol×K 890.29 Joback Calculated Property
Cp,gas 920.40 J/mol×K 930.20 Joback Calculated Property

Similar Compounds

Sandaracopimaridiene. 15-Isopimaradiene. 1-(2,2,3,5,6-Pentamethylcyclohex-4-enyl)-9-(3,3,4-trimethylcyclohex-1-enyl)-3,6-dimethyl-6-ethenyl-dec-4-ene. 5-{(4E)-3,6-dimethyl-6-[3-(3,3,4-trimethyl-1-cyclohexenyl)butyl]-4,7-octadienyl}-1,3,4,4,6-pentamethyl-1-cyclohexene, isomer # 2. 5-{(4E)-3,6-dimethyl-6-[3-(3,3,4-trimethyl-1-cyclohexenyl)butyl]-4,7-octadienyl}-1,3,4,4,6-pentamethyl-1-cyclohexene, isomer # 1. 1,1,6-trimethyl-3-methylene-2-(3,6,10,13,14-pentamethyl-3-ethenyl-pentadec-4-enye)cyclohexane. Phenanthrene, 7-ethenyl-1,2,3,4,4a,4b,5,6,7,8,10,10a-dodecahydro-1,1,4a,7-tetramethyl-, [4aS-(4a«alpha»,4b«beta»,7«beta»,10a«beta»)]-. 2-{(4E)-3,6-dimethyl-6-[3-(3,3,4-trimethylcyclohexyliden)butyl]-4,7-octadienyl}-1,1,6-trimethyl-3-methylenecyclohexane, isomer # 1. 2-{(4E)-3,6-dimethyl-6-[3-(3,3,4-trimethylcyclohexyliden)butyl]-4,7-octadienyl}-1,1,6-trimethyl-3-methylenecyclohexane, isomer # 2. 5-[(4E)-3,6-dimethyl-6-(3,4,7,8-tetramethylnonyl)-4,7-octadienyl]-1,3,4,4,6-pentamethyl-1-cyclohexene. 1-Phenanthrenecarboxaldehyde, 7-ethenyl-1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a,7-trimethyl-, [1R-(1«alpha»,4a«beta»,4b«alpha»,7«beta»,10a«alpha»)]-. Sandaracopimarinal. 1,1,6-trimethyl-3-methylene-2-[(4E)-3,6,13,14-tetramethyl-10-methylene-6-vinyl-4,14-pentadecadienyl]cyclohexane, isomer # 1. 1,1,6-trimethyl-3-methylene-2-[(4E)-3,6,13,14-tetramethyl-10-methylene-6-vinyl-4,14-pentadecadienyl]cyclohexane, isomer # 3. 1,1,6-trimethyl-3-methylene-2-[(4E)-3,6,13,14-tetramethyl-10-methylene-6-vinyl-4,14-pentadecadienyl]cyclohexane, isomer # 4.

Find more compounds similar to Phenanthrene, 7-ethenyl-1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,1,4a,7-tetramethyl-, [4aS-(4a«alpha»,4b«beta»,7«beta»,10a«beta»)]-.

Sources

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