- InChI
- InChI=1S/C20H34/c1-2-8-15(9-3-1)20-18-12-6-4-10-16(18)14-17-11-5-7-13-19(17)20/h15-20H,1-14H2
- InChI Key
- AEAADDYLRBDYCJ-UHFFFAOYSA-N
- Formula
- C20H34
- SMILES
- C1CCC(C2C3CCCCC3CC3CCCCC32)CC1
- Molecular Weight1
- 274.48
- CAS
- 55255-70-4
- Other Names
-
- 9-Cyclohexyl-(tetrahydroanthracene)
- 9-Cyclohexylperhydroanthracene
- 9-Cyclohexyltetradecahydroanthracene
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- ΔvapH : Enthalpy of vaporization at a given temperature (kJ/mol).
- IE : Ionization energy (eV).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Tboil : Normal Boiling Point Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -270.13 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 25.44 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.81 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.09 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 6.199 | Crippen Calculated Property | |
| McVol | 249.220 | ml/mol | McGowan Calculated Property |
| Tboil | 642.29 | K | Relay (1.0) Calculated Property |
| Tfus | 382.26 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, 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 |
|---|---|---|---|---|
| ΔvapH | 74.50 | kJ/mol | 453.50 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [301.38; 997.65] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | -2.45350e+02 | |||
| Coefficient B | 2.37760e+00 | |||
| Coefficient C | -1.46300e-03 | |||
| Coefficient D | 3.28400e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 301.38 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 427.23 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 538.53 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 636.32 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 721.65 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 795.55 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 859.07 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 913.23 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 959.08 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 997.65 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0044172; 0.0007168] | Pa×s | [350.28; 666.80] |
Joback Predicted correlation
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -9.25308e+00 | |||
| Coefficient B | 1.34186e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 350.28 | |||
| Temperature range, max. | 666.80 | |||
| η | 0.0044172 | Pa×s | 350.28 | Calculated Property |
| η | 0.0031142 | Pa×s | 385.45 | Calculated Property |
| η | 0.0023277 | Pa×s | 420.62 | Calculated Property |
| η | 0.0018198 | Pa×s | 455.79 | Calculated Property |
| η | 0.0014738 | Pa×s | 490.95 | Calculated Property |
| η | 0.0012277 | Pa×s | 526.12 | Calculated Property |
| η | 0.0010464 | Pa×s | 561.29 | Calculated Property |
| η | 0.0009088 | Pa×s | 596.46 | Calculated Property |
| η | 0.0008018 | Pa×s | 631.63 | Calculated Property |
| η | 0.0007168 | Pa×s | 666.80 | Calculated Property |
Similar Compounds
Find more compounds similar to Anthracene, 9-cyclohexyltetradecahydro-.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
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