Chemical Properties of Perhydrophenanthrene, 1B-(3R,7-dimethylnonyl)-2A,4bB,8,8,10aB-pentamethyl

Perhydrophenanthrene, 1B-(3R,7-dimethylnonyl)-2A,4bB,8,8,10aB-pentamethyl

InChI
InChI=1S/C30H56/c1-9-22(2)12-10-13-23(3)14-16-25-24(4)15-17-27-29(25,7)21-18-26-28(5,6)19-11-20-30(26,27)8/h22-27H,9-21H2,1-8H3/t22?,23-,24-,25+,26?,27?,29-,30-/m0/s1
InChI Key
LKFHRJUTBBHMDC-NRSLZMCPSA-N
Formula
C30H56
SMILES
CCC(C)CCCC(C)CCC1C(C)CCC2C1(C)CCC1C(C)(C)CCCC12C
Molecular Weight1
416.77
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ΔfusH° 35.70 kJ/mol Joback Calculated Property
logPoct/wat 9.914 Crippen Calculated Property
McVol 400.980 ml/mol McGowan Calculated Property
Inp [2970.00; 2970.00]   Show Hide
Inp 2970.00 NIST
Inp 2970.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1473.55; 1700.51] J/mol×K [908.53; 1123.97] Show Hide
Cp,gas 1473.55 J/mol×K 908.53 Joback Calculated Property
Cp,gas 1508.97 J/mol×K 944.44 Joback Calculated Property
Cp,gas 1544.87 J/mol×K 980.34 Joback Calculated Property
Cp,gas 1581.63 J/mol×K 1016.25 Joback Calculated Property
Cp,gas 1619.58 J/mol×K 1052.16 Joback Calculated Property
Cp,gas 1659.09 J/mol×K 1088.06 Joback Calculated Property
Cp,gas 1700.51 J/mol×K 1123.97 Joback Calculated Property

Similar Compounds

Perhydrophenanthrene, 1B-ethyl-2B,4bB,8,8,10aB-pentamethyl. Perhydrophenanthrene, 1B-(3R,7-dimethyldecyl)-2A,4bB,8,8,10aB-pentamethyl. Perhydrophenanthrene, 1A-ethyl-2A,4bB,8,8,10aB-pentamethyl. Perhydrophenanthrene, 1B-butyl-2A,4bB,8,8,10aB-pentamethyl. Perhydrophenanthrene, 1B-(3R-methyloctyl)-2A,4bB,8,8,10aB-pentamethyl. Perhydrophenanthrene, 1B-(3S,7-dimethylnonyl)-2A,4bB,8,8,10aB-pentamethyl. Perhydrophenanthrene, 1B-(3-methylpentyl)-2A,4bB,8,8,10aB-pentamethyl. Perhydrophenanthrene, 1B-(3S-methylhexyl)-2A,4bB,8,8,10aB-pentamethyl. 1-Isopropyl-4-methyl-2-[1,5,9-trimethyl-1-(4-methyl-hexyl)-decyl]-cyclohexane. Perhydrophenanthrene, 1A-(3R/S,7-dimethyldecyl)-2A,4bB,8,8,10aB-pentamethyl. 7-Ethyl-1,4a,7-trimethyl-tetradecahydro-phenanthrene, b. 8«beta»(H)-Labdane. Perhydrophenanthrene, 1B-(3S-methyloctyl)-2A,4bB,8,8,10aB-pentamethyl. 8-«beta»(H)-Homodrimane. Perhydrophenanthrene, 1B-(3S,7-dimethyldecyl)-2A,4bB,8,8,10aB-pentamethyl.

Find more compounds similar to Perhydrophenanthrene, 1B-(3R,7-dimethylnonyl)-2A,4bB,8,8,10aB-pentamethyl.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.