- InChI
- InChI=1S/C22H38/c1-3-13-21-17(7-1)9-5-11-19(21)15-16-20-12-6-10-18-8-2-4-14-22(18)20/h17-22H,1-16H2
- InChI Key
- HMDCHOYMNYXBBN-UHFFFAOYSA-N
- Formula
- C22H38
- SMILES
-
C1CCC2C(C1)CCCC2CCC1CCCC2CCCCC
21 - Molecular Weight1
- 302.55
- Other Names
-
- 1,2-Di(decahydro-1-naphthyl)ethane
- 1,2-Di(1'-decahydronaphthyl)ethane
- Naphthalene, 1,1'-(1,2-ethanediyl)bis*decahydro-
- 1,2-bis(decahydro-1-naphthyl)ethane
- 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 | -371.95 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 30.62 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 99.67 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.15 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 6.980 | Crippen Calculated Property | |
| McVol | 277.400 | ml/mol | McGowan Calculated Property |
| Tboil | 668.12 | K | Relay (1.0) Calculated Property |
| Tfus | 351.06 | 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 | 89.30 | kJ/mol | 473.50 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [343.81; 1100.83] | 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 | -2.47168e+02 | |||
| Coefficient B | 2.56760e+00 | |||
| Coefficient C | -1.57180e-03 | |||
| Coefficient D | 3.52200e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 343.81 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 480.06 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 600.68 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 706.78 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 799.48 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 879.88 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 949.10 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 1008.26 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 1058.46 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 1100.83 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0042988; 0.0006469] | Pa×s | [372.82; 692.23] |
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 | -9.55377e+00 | |||
| Coefficient B | 1.53018e+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. | 372.82 | |||
| Temperature range, max. | 692.23 | |||
| η | 0.0042988 | Pa×s | 372.82 | Calculated Property |
| η | 0.0030089 | Pa×s | 408.31 | Calculated Property |
| η | 0.0022298 | Pa×s | 443.80 | Calculated Property |
| η | 0.0017274 | Pa×s | 479.29 | Calculated Property |
| η | 0.0013861 | Pa×s | 514.78 | Calculated Property |
| η | 0.0011443 | Pa×s | 550.27 | Calculated Property |
| η | 0.0009669 | Pa×s | 585.76 | Calculated Property |
| η | 0.0008328 | Pa×s | 621.25 | Calculated Property |
| η | 0.0007290 | Pa×s | 656.74 | Calculated Property |
| η | 0.0006469 | Pa×s | 692.23 | Calculated Property |
Similar Compounds
Find more compounds similar to Naphthalene, 1,1'-(1,2-ethanediyl)bis[decahydro-.
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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