- InChI
- InChI=1S/C11H22/c1-2-3-8-11-9-6-4-5-7-10-11/h11H,2-10H2,1H3
- InChI Key
- LRWGCEBGEHKILW-UHFFFAOYSA-N
- Formula
- C11H22
- SMILES
- CCCCC1CCCCCC1
- Molecular Weight1
- 154.30
- 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).
- Inp : Non-polar retention indices.
- 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 | 0.3387 | Relay (1.0) Calculated Property | |
| ΔfG° | 54.09 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -226.61 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 13.98 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 52.75 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.67 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.70 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.147 | Crippen Calculated Property | |
| McVol | 154.990 | ml/mol | McGowan Calculated Property |
| Pc | 2393.53 | kPa | Joback Calculated Property |
| Inp | [1171.00; 1171.00] |
|
|
| Inp | 1171.00 | NIST | |
| Inp | 1171.00 | NIST | |
| Tboil | 480.47 | K | Relay (1.0) Calculated Property |
| Tc | 675.89 | K | Relay (1.0) Calculated Property |
| Tfus | 201.57 | K | Relay (1.0) Calculated Property |
| Vc | 0.555 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [195.82; 573.68] | 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 | -7.78370e+01 | |||
| Coefficient B | 1.16132e+00 | |||
| Coefficient C | -6.09200e-04 | |||
| Coefficient D | 9.94000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 195.82 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 261.17 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 319.94 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 372.45 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 419.02 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 459.95 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 495.57 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 526.19 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 552.12 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 573.68 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0138769; 0.0002109] | Pa×s | [217.59; 474.05] |
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 | -1.20161e+01 | |||
| Coefficient B | 1.68384e+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. | 217.59 | |||
| Temperature range, max. | 474.05 | |||
| η | 0.0138769 | Pa×s | 217.59 | Calculated Property |
| η | 0.0056640 | Pa×s | 246.09 | Calculated Property |
| η | 0.0027844 | Pa×s | 274.58 | Calculated Property |
| η | 0.0015643 | Pa×s | 303.08 | Calculated Property |
| η | 0.0009704 | Pa×s | 331.57 | Calculated Property |
| η | 0.0006493 | Pa×s | 360.07 | Calculated Property |
| η | 0.0004608 | Pa×s | 388.57 | Calculated Property |
| η | 0.0003427 | Pa×s | 417.06 | Calculated Property |
| η | 0.0002647 | Pa×s | 445.56 | Calculated Property |
| η | 0.0002109 | Pa×s | 474.05 | Calculated Property |
Similar Compounds
Find more compounds similar to Cycloheptane, butyl.
Sources
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