Chemical Properties of C35 17A,21B,22S-Hopane

C35 17A,21B,22S-Hopane

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InChI
InChI=1S/C35H62/c1-24(2)12-10-13-25(3)26-16-21-32(6)27(26)17-22-34(8)29(32)14-15-30-33(7)20-11-19-31(4,5)28(33)18-23-35(30,34)9/h24-30H,10-23H2,1-9H3/t25?,26-,27?,28?,29?,30?,32-,33?,34?,35?/m1/s1
InChI Key
STDQCAQCXFHIQA-MXSLBLIISA-N
Formula
C35H62
SMILES
CC(C)CCCC(C)C1CCC2(C)C1CCC1(C)C2CCC2C3(C)CCCC(C)(C)C3CCC21C
Molecular Weight1
482.87
Sources

Physical Properties

Property Value Unit Source
Δf 404.09 kJ/mol Joback Calculated Property
Δfgas -474.75 kJ/mol Joback Calculated Property
Δfus 31.30 kJ/mol Joback Calculated Property
Δvap 86.02 kJ/mol Joback Calculated Property
logPoct/wat 10.94 Crippen Calculated Property
Pc 729.67 kPa Joback Calculated Property
Tboil 1036.49 K Joback Calculated Property
Tc 1277.54 K Joback Calculated Property
Tfus 621.09 K Joback Calculated Property
Vc 1.71 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1857.54 J/mol×K 1036.49 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 2
-CH2- 3
>C< (ring) 5
-CH3 9
>CH- (ring) 5
-CH2- (ring) 11

Similar Compounds

C31-Hopane, 17bH, 21bH. 17«beta»(H),21«alpha»(H)-Homomoretane. moretane. 1H-Cyclopenta[a]phenanthrene, 17-(1,5-dimethylhexyl)hexadecahydro-4,4,10,13,14-pentamethyl-, [5S-[5«alpha»,8«beta»,9«alpha»,10«beta»,13«beta»,14«alpha»,17«beta»(S*)]]-. 4,14,24-trimethylcholestane. C35 17A,21B,22R-Hopane. 17-«alpha»-H-Homohopane, 22(R). C32-25-Norhopane, 17aH, 21bH, 22R. C33-25-Norhopane, 17aH, 21bH, 22R. Isolongifolene, 4,5,9,10-tetrahydro. 3-sec-Butyl-5a,5b,8,8,11a,13b-hexamethyl-eicosahydro-cyclopenta[a]chrysene. 17-«alpha»-H-bis-Homohopane, 22(S). 17«alpha»H-moretane. C32-Hopane, 17bH, 21aH, 22RS. C33-Hopane, 17aH, 21bH, 22R.

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