- InChI
- InChI=1S/C9H18O/c1-10-8-7-9-5-3-2-4-6-9/h9H,2-8H2,1H3
- InChI Key
- SCKZEHIXKJLFOB-UHFFFAOYSA-N
- Formula
- C9H18O
- SMILES
- COCCC1CCCCC1
- Molecular Weight1
- 142.24
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- 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).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.3402 | Relay (1.0) Calculated Property | |
| ΔfG° | -55.65 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -300.95 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 12.09 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 50.31 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.35 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.89 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.603 | Crippen Calculated Property | |
| McVol | 132.680 | ml/mol | McGowan Calculated Property |
| Pc | 2787.66 | kPa | Joback Calculated Property |
| Tboil | 457.22 | K | Relay (1.0) Calculated Property |
| Tc | 659.18 | K | Relay (1.0) Calculated Property |
| Tfus | 214.00 | K | Relay (1.0) Calculated Property |
| Vc | 0.460 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [173.69; 487.22] | 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 | -4.53980e+01 | |||
| Coefficient B | 9.17720e-01 | |||
| Coefficient C | -4.35800e-04 | |||
| Coefficient D | 5.07000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 173.69 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 226.97 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 275.27 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 318.74 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 357.54 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 391.85 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 421.80 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 447.58 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 469.33 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 487.22 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0059362; 0.0002296] | Pa×s | [220.80; 451.89] |
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 | -1.14865e+01 | |||
| Coefficient B | 1.40424e+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. | 220.80 | |||
| Temperature range, max. | 451.89 | |||
| η | 0.0059362 | Pa×s | 220.80 | Calculated Property |
| η | 0.0030604 | Pa×s | 246.48 | Calculated Property |
| η | 0.0017879 | Pa×s | 272.15 | Calculated Property |
| η | 0.0011459 | Pa×s | 297.83 | Calculated Property |
| η | 0.0007882 | Pa×s | 323.51 | Calculated Property |
| η | 0.0005728 | Pa×s | 349.18 | Calculated Property |
| η | 0.0004349 | Pa×s | 374.86 | Calculated Property |
| η | 0.0003420 | Pa×s | 400.54 | Calculated Property |
| η | 0.0002769 | Pa×s | 426.21 | Calculated Property |
| η | 0.0002296 | Pa×s | 451.89 | Calculated Property |
Similar Compounds
Find more compounds similar to Cyclohexane, (2-methoxyethyl)-.
Sources
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