Chemical Properties of 17«alpha»H-moretane

17«alpha»H-moretane

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InChI
InChI=1S/C30H52/c1-20(2)21-12-17-27(5)22(21)13-18-29(7)24(27)10-11-25-28(6)16-9-15-26(3,4)23(28)14-19-30(25,29)8/h20-25H,9-19H2,1-8H3/t21-,22-,23?,24?,25?,27+,28+,29-,30-/m0/s1
InChI Key
ZRLNBWWGLOPJIC-XDZDYSHNSA-N
Formula
C30H52
SMILES
CC(C)C1CCC2(C)C1CCC1(C)C2CCC2C3(C)CCCC(C)(C)C3CCC21C
Molecular Weight1
412.73
Sources

Physical Properties

Property Value Unit Source
Δf 364.43 kJ/mol Joback Calculated Property
Δfgas -366.27 kJ/mol Joback Calculated Property
Δfus 21.87 kJ/mol Joback Calculated Property
Δvap 75.28 kJ/mol Joback Calculated Property
logPoct/wat 9.13 Crippen Calculated Property
Pc 958.51 kPa Joback Calculated Property
Tboil 922.53 K Joback Calculated Property
Tc 1166.60 K Joback Calculated Property
Tfus 579.74 K Joback Calculated Property
Vc 1.43 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1454.25 J/mol×K 922.53 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
>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-bis-Homohopane, 22(S). C32-Hopane, 17bH, 21aH, 22RS. C33-Hopane, 17aH, 21bH, 22R.

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