Chemical Properties of 3-sec-Butyl-5a,5b,8,8,11a,13b-hexamethyl-eicosahydro-cyclopenta[a]chrysene

3-sec-Butyl-5a,5b,8,8,11a,13b-hexamethyl-eicosahydro-cyclopenta[a]chrysene

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InChI
InChI=1S/C31H54/c1-9-21(2)22-13-18-28(5)23(22)14-19-30(7)25(28)11-12-26-29(6)17-10-16-27(3,4)24(29)15-20-31(26,30)8/h21-26H,9-20H2,1-8H3
InChI Key
QFBGIDMRCNNMIW-UHFFFAOYSA-N
Formula
C31H54
SMILES
CCC(C)C1CCC2(C)C1CCC1(C)C2CCC2C3(C)CCCC(C)(C)C3CCC21C
Molecular Weight1
426.76
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Physical Properties

Property Value Unit Source
Δf 372.85 kJ/mol Joback Calculated Property
Δfgas -386.91 kJ/mol Joback Calculated Property
Δfus 24.46 kJ/mol Joback Calculated Property
Δvap 77.51 kJ/mol Joback Calculated Property
log10WS -9.61 Crippen Calculated Property
logPoct/wat 9.524 Crippen Calculated Property
McVol 393.350 ml/mol McGowan Calculated Property
Pc 903.97 kPa Joback Calculated Property
Inp 3167.63 NIST
Tboil 945.41 K Joback Calculated Property
Tc 1186.91 K Joback Calculated Property
Tfus 591.01 K Joback Calculated Property
Vc 1.488 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1530.77; 1896.43] J/mol×K [945.41; 1186.91] Show Hide
Cp,gas 1530.77 J/mol×K 945.41 Joback Calculated Property
Cp,gas 1580.09 J/mol×K 985.66 Joback Calculated Property
Cp,gas 1633.01 J/mol×K 1025.91 Joback Calculated Property
Cp,gas 1690.31 J/mol×K 1066.16 Joback Calculated Property
Cp,gas 1752.79 J/mol×K 1106.41 Joback Calculated Property
Cp,gas 1821.23 J/mol×K 1146.66 Joback Calculated Property
Cp,gas 1896.43 J/mol×K 1186.91 Joback Calculated Property

Similar Compounds

28-Nor-17«beta»(H)-hopane. C33-25-Norhopane, 17aH, 21bH, 22R. 17-«alpha»-H-bis-Homohopane, 22(R). 17-«alpha»-H-Homohopane, 22(S). C30 17A,21B-Hopane. 17«beta»,21«alpha»(H)-norhopane. C29 17A,21B-Hopane. 17«beta»(H),21«alpha»(H)-30-Normoretane. C32-25-Norhopane, 17aH, 21bH, 22R. 17-«beta»-H-nor-Hopane. C33-25-Norhopane, 17aH, 21bH, 22S. C32 17A,21B,22R-Hopane. C32 17A,21B,22S-Hopane. C32-Hopane, 17bH, 21aH, 22RS. 17-«alpha»-H-bis-Homohopane, 22(S).

Find more compounds similar to 3-sec-Butyl-5a,5b,8,8,11a,13b-hexamethyl-eicosahydro-cyclopenta[a]chrysene.

Sources

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