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
Ip [2229.00; 2287.00]   Show Hide
Ip 2243.00 NIST
Ip 2279.00 NIST
Ip 2255.00 NIST
Ip 2229.00 NIST
Ip 2287.00 NIST
Ip 2287.00 NIST
Ip 2287.00 NIST
Ip 2243.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [313.98; 971.71] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-3.10630e+02
Coefficient B2.99578e+00
Coefficient C-2.92294e-03
Coefficient D1.20950e-06
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 313.98 J/mol×K 273.00 Calculated Property
Cp,gas 436.93 J/mol×K 353.78 Calculated Property
Cp,gas 538.49 J/mol×K 434.56 Calculated Property
Cp,gas 622.48 J/mol×K 515.33 Calculated Property
Cp,gas 692.73 J/mol×K 596.11 Calculated Property
Cp,gas 753.06 J/mol×K 676.89 Calculated Property
Cp,gas 807.30 J/mol×K 757.67 Calculated Property
Cp,gas 859.27 J/mol×K 838.44 Calculated Property
Cp,gas 912.80 J/mol×K 919.22 Calculated Property
Cp,gas 971.71 J/mol×K 1000.00 Calculated Property

Similar Compounds

15-Isopimaradiene. Sandaracopimaridiene. 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-(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. 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 # 5. 1,1,6-trimethyl-3-methylene-2-[(4E)-3,6,13,14-tetramethyl-10-methylene-6-vinyl-4,14-pentadecadienyl]cyclohexane, isomer # 4. 1,1,6-trimethyl-3-methylene-2-[(4E)-3,6,13,14-tetramethyl-10-methylene-6-vinyl-4,14-pentadecadienyl]cyclohexane, isomer # 1.

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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