Chemical Properties of Perhydrophenanthrene, 2A,4bB,8,8,10aB-pentamethyl-1A-(3R/S-methyl-7-oxooctyl)

Perhydrophenanthrene, 2A,4bB,8,8,10aB-pentamethyl-1A-(3R/S-methyl-7-oxooctyl)

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InChI
InChI=1S/C28H50O/c1-20(10-8-11-22(3)29)12-14-23-21(2)13-15-25-27(23,6)19-16-24-26(4,5)17-9-18-28(24,25)7/h20-21,23-25H,8-19H2,1-7H3/t20?,21-,23-,24?,25?,27-,28-/m0/s1
InChI Key
DJTIKPPBMWKDMJ-SGQUFSSSSA-N
Formula
C28H50O
SMILES
CC(=O)CCCC(C)CCC1C(C)CCC2C1(C)CCC1C(C)(C)CCCC12C
Molecular Weight1
402.70
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Physical Properties

Property Value Unit Source
Δf 127.96 kJ/mol Joback Calculated Property
Δfgas -587.15 kJ/mol Joback Calculated Property
Δfus 35.65 kJ/mol Joback Calculated Property
Δvap 80.19 kJ/mol Joback Calculated Property
log10WS -8.57 Crippen Calculated Property
logPoct/wat 8.457 Crippen Calculated Property
McVol 374.370 ml/mol McGowan Calculated Property
Pc 908.89 kPa Joback Calculated Property
Inp [3075.00; 3075.00]   Show Hide
Inp 3075.00 NIST
Inp 3075.00 NIST
Tboil 917.08 K Joback Calculated Property
Tc 1137.68 K Joback Calculated Property
Tfus 531.21 K Joback Calculated Property
Vc 1.425 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1372.45; 1594.57] J/mol×K [917.08; 1137.68] Show Hide
Cp,gas 1372.45 J/mol×K 917.08 Joback Calculated Property
Cp,gas 1406.44 J/mol×K 953.85 Joback Calculated Property
Cp,gas 1441.15 J/mol×K 990.61 Joback Calculated Property
Cp,gas 1476.94 J/mol×K 1027.38 Joback Calculated Property
Cp,gas 1514.20 J/mol×K 1064.15 Joback Calculated Property
Cp,gas 1553.28 J/mol×K 1100.92 Joback Calculated Property
Cp,gas 1594.57 J/mol×K 1137.68 Joback Calculated Property

Similar Compounds

Perhydrophenanthrene, 2B,4bB,8,8,10aB-pentamethyl-1A-(3R-methyl-7-oxooctyl). Perhydrophenanthrene, 2B,4bB,8,8,10aB-pentamethyl-1A-(3S-methyl-7-oxooctyl). Perhydrophenanthrene, 2A,4bB,8,8,10aB-pentamethyl-1B-(3-oxobutyl). Perhydrophenanthrene, 2A,4bB,8,8,10aB-pentamethyl-1A-(3-oxobutyl). Perhydrophenanthrene, 2B,4bB,8,8,10aB-pentamethyl-1B-(3-oxobutyl). Perhydrophenanthrene, 2B,4bB,8,8,10aB-pentamethyl-1A-(3-oxobutyl). Tetrahydroionone. 2-Butanone, 4-(2,2,6-trimethylcyclohexyl)-. Cyclohexanone, 4-(1,1-dimethylpropyl)-. Cholestan-3-one. Cholestan-3-one, (5«beta»)-. Cholestan-3-one, (5«alpha»)-. koprostan-3-one. 5«alpha»-Stigmastan-3-one. 5«alpha»-Stigmastan-3-one.

Find more compounds similar to Perhydrophenanthrene, 2A,4bB,8,8,10aB-pentamethyl-1A-(3R/S-methyl-7-oxooctyl).

Sources

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