Chemical Properties of 17-«alpha»-H-bis-Homohopane, 22(S)

17-«alpha»-H-bis-Homohopane, 22(S)

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InChI
InChI=1S/C32H56/c1-9-11-22(2)23-14-19-29(5)24(23)15-20-31(7)26(29)12-13-27-30(6)18-10-17-28(3,4)25(30)16-21-32(27,31)8/h22-27H,9-21H2,1-8H3/t22-,23?,24-,25?,26?,27?,29+,30+,31-,32-/m0/s1
InChI Key
OWRSREGIRFCWIJ-QQLCMTSWSA-N
Formula
C32H56
SMILES
CCCC(C)C1CCC2(C)C1CCC1(C)C2CCC2C3(C)CCCC(C)(C)C3CCC21C
Molecular Weight1
440.79
Sources

Physical Properties

Property Value Unit Source
Δf 381.27 kJ/mol Joback Calculated Property
Δfgas -407.55 kJ/mol Joback Calculated Property
Δfus 27.05 kJ/mol Joback Calculated Property
Δvap 79.73 kJ/mol Joback Calculated Property
logPoct/wat 9.91 Crippen Calculated Property
Pc 853.96 kPa Joback Calculated Property
Tboil 968.29 K Joback Calculated Property
Tc 1208.02 K Joback Calculated Property
Tfus 602.28 K Joback Calculated Property
Vc 1.54 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1609.29 J/mol×K 968.29 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-CH2- 2
>C< (ring) 5
-CH3 8
>CH- (ring) 5
-CH2- (ring) 11

Similar Compounds

C31-Hopane, 17bH, 21bH. 17«beta»(H),21«alpha»(H)-Homomoretane. C35 17A,21B,22S-Hopane. 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-moretane. C32-Hopane, 17bH, 21aH, 22RS. C33-Hopane, 17aH, 21bH, 22R.

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