Chemical Properties of Perhydrophenanthrene, 1B-isopentyl-2A,4bB,8,8,10aB-pentamethyl

Perhydrophenanthrene, 1B-isopentyl-2A,4bB,8,8,10aB-pentamethyl

InChI
InChI=1S/C24H44/c1-17(2)9-11-19-18(3)10-12-21-23(19,6)16-13-20-22(4,5)14-8-15-24(20,21)7/h17-21H,8-16H2,1-7H3/t18-,19+,20?,21?,23-,24-/m1/s1
InChI Key
NMRHSKVRUWBTQL-UOTPHTBUSA-N
Formula
C24H44
SMILES
CC(C)CCC1C(C)CCC2C1(C)CCC1C(C)(C)CCCC12C
Molecular Weight1
332.61
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° 23.69 kJ/mol Joback Calculated Property
logPoct/wat 7.718 Crippen Calculated Property
McVol 316.440 ml/mol McGowan Calculated Property
Inp [2398.00; 2398.00]   Show Hide
Inp 2398.00 NIST
Inp 2398.00 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [416.79; 1254.78] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-3.23158e+02
Coefficient B3.46424e+00
Coefficient C-3.08980e-03
Coefficient D1.20350e-06
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 416.79 J/mol×K 273.00 Calculated Property
Cp,gas 568.99 J/mol×K 353.78 Calculated Property
Cp,gas 697.53 J/mol×K 434.56 Calculated Property
Cp,gas 806.23 J/mol×K 515.33 Calculated Property
Cp,gas 898.89 J/mol×K 596.11 Calculated Property
Cp,gas 979.32 J/mol×K 676.89 Calculated Property
Cp,gas 1051.31 J/mol×K 757.67 Calculated Property
Cp,gas 1118.68 J/mol×K 838.44 Calculated Property
Cp,gas 1185.24 J/mol×K 919.22 Calculated Property
Cp,gas 1254.78 J/mol×K 1000.00 Calculated Property

Similar Compounds

Naphthalene, decahydro-1,4a-dimethyl-7-(1-methylethyl)-, [1S-(1«alpha»,4a«alpha»,7«alpha»,8a«beta»)]-. Onocerane II (8-«alpha»-H, 14-«alpha»-H). C16-Homodrimane. Naphthalene, decahydro-1,8a-dimethyl-7-(1-methylethyl)-, [1R-(1«alpha»,4a«beta»,7«beta»,8a«alpha»)]-. Onocerane I (8-«beta»-H, 14-«alpha»-H). Perhydrophenanthrene, 1B-(3S,7-dimethyloctyl)-2A,4bB,8,8,10aB-pentamethyl. Abietane. 7-Isopropyl-1,1,4a-trimethyl-tetradecahydro-phenanthrene. (1S,4aS,4bS,7S,8aS,10aS)-7-Isopropyl-1,4a-dimethyltetradecahydrophenanthrene. 4«beta»H,5«alpha»H-Eudesmane. onocerane-III. 18-Norabietane. onocerane-I. Eudesmane-isomer. onocerane-II.

Find more compounds similar to Perhydrophenanthrene, 1B-isopentyl-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.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
These property values are available through the Cheméo API. A free account gives you an access key.