Chemical Properties of Phenanthrene, 7-ethenyl-1,2,3,4,4a,4b,5,6,7,8,8a,9-dodecahydro-1,1,4b,7-tetramethyl-, [4aS-(4a«alpha»,4b«beta»,7«alpha»,8a«alpha»)]- (CAS 1686-67-5)

Phenanthrene, 7-ethenyl-1,2,3,4,4a,4b,5,6,7,8,8a,9-dodecahydro-1,1,4b,7-tetramethyl-, [4aS-(4a«alpha»,4b«beta»,7«alpha»,8a«alpha»)]-

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InChI
InChI=1S/C20H32/c1-6-19(4)12-13-20(5)15(14-19)9-10-16-17(20)8-7-11-18(16,2)3/h6,10,15,17H,1,7-9,11-14H2,2-5H3/t15?,17?,19-,20-/m1/s1
InChI Key
BAIWMJSLFJWAQP-LYBGUNNDSA-N
Formula
C20H32
SMILES
C=CC1(C)CCC2(C)C(CC=C3C2CCCC3(C)C)C1
Molecular Weight1
272.47
CAS
1686-67-5
Other Names
  • Rimuen
  • Rimuene
  • 5,15-Rosadiene
  • Rosa-5,15-diene, (13S)-
  • Phenanthrene, 7-ethenyl-1,2,3,4,4a,4b,5,6,7,8,8a,9-dodecahydro-1,1,4b,7-tetramethyl-, (4aS,4bR,7S,8aR)-
  • Rosa-5,15-diene

Physical Properties

Property Value Unit Source
Δf 315.55 kJ/mol Joback Calculated Property
Δfgas -91.75 kJ/mol Joback Calculated Property
Δfus 14.26 kJ/mol Joback Calculated Property
Δvap 56.93 kJ/mol Joback Calculated Property
log10WS -6.38 Crippen Calculated Property
logPoct/wat 6.142 Crippen Calculated Property
McVol 251.480 ml/mol McGowan Calculated Property
Pc 1611.58 kPa Joback Calculated Property
Inp [1884.00; 1953.00]   Show Hide
Inp 1884.00 NIST
Inp 1906.00 NIST
Inp 1914.00 NIST
Inp 1936.00 NIST
Inp 1886.00 NIST
Inp 1927.00 NIST
Inp 1930.00 NIST
Inp 1894.00 NIST
Inp 1930.00 NIST
Inp 1930.00 NIST
Inp 1930.00 NIST
Inp 1894.00 NIST
Inp 1901.90 NIST
Inp 1926.00 NIST
Inp Outlier 1953.00 NIST
Inp 1894.00 NIST
Inp 1894.00 NIST
Inp 1926.00 NIST
Inp 1901.90 NIST
Inp 1884.00 NIST
Inp 1927.00 NIST
I [2156.00; 2233.00]   Show Hide
I 2156.00 NIST
I 2187.00 NIST
I 2200.00 NIST
I 2233.00 NIST
I 2232.00 NIST
I 2232.00 NIST
Tboil 690.77 K Joback Calculated Property
Tc 930.20 K Joback Calculated Property
Tfus 426.12 K Joback Calculated Property
Vc 0.946 m3/kmol Joback Calculated Property

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

Urs-12-ene. isopimaridiene. Isopimara-9(11),15-diene. iso-Pimar-9(11),15-diene. 24-Norursa-3,12-diene. 24-Noroleana-3,12-diene. Aristolochene. 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»)]-. «delta»-patchoulene. Eremophyllene. Valencene (isomer I). Naphthalene, 1,2,3,5,6,7,8,8a-octahydro-1,8a-dimethyl-7-(1-methylethenyl)-, [1S-(1«alpha»,7«alpha»,8a«alpha»)]-. Naphthalene, 1,2,3,5,6,7,8,8a-octahydro-1,8a-dimethyl-7-(1-methylethenyl)-, [1R-(1«alpha»,7«beta»,8a«alpha»)]-. Valencene (isomer II). (4aS,5S,8aS)-5-Isopentyl-1,1,4a,6-tetramethyl-1,2,3,4,4a,5,8,8a-octahydronaphthalene.

Find more compounds similar to Phenanthrene, 7-ethenyl-1,2,3,4,4a,4b,5,6,7,8,8a,9-dodecahydro-1,1,4b,7-tetramethyl-, [4aS-(4a«alpha»,4b«beta»,7«alpha»,8a«alpha»)]-.

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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