- InChI
- InChI=1S/C10H21N/c1-9(2)8-11-10-6-4-3-5-7-10/h9-11H,3-8H2,1-2H3
- InChI Key
- ARHUUPGCYHESJV-UHFFFAOYSA-N
- Formula
- C10H21N
- SMILES
- CC(C)CNC1CCCCC1
- Molecular Weight1
- 155.29
- Other Names
-
- N-isobutylcyclohexylamine
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- 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).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.3980 | Relay (1.0) Calculated Property | |
| ΔfH°gas | -178.45 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 15.07 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 50.66 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.03 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 2.565 | Crippen Calculated Property | |
| McVol | 150.880 | ml/mol | McGowan Calculated Property |
| Pc | 2624.46 | kPa | Joback Calculated Property |
| Inp | [1135.00; 1135.00] |
|
|
| Inp | 1135.00 | NIST | |
| Inp | 1135.00 | NIST | |
| Tboil | 475.62 | K | Relay (1.0) Calculated Property |
| Tc | 663.18 | K | Relay (1.0) Calculated Property |
| Tfus | 247.85 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, 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 | [195.37; 557.74] | 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 | -7.46990e+01 | |||
| Coefficient B | 1.15804e+00 | |||
| Coefficient C | -6.53000e-04 | |||
| Coefficient D | 1.27400e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 195.37 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 258.90 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 315.68 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 366.10 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 410.57 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 449.49 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 483.26 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 512.29 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 536.99 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 557.74 | J/mol×K | 1000.00 | Calculated Property |
Similar Compounds
Find more compounds similar to Cyclohexanamine, N-(2-methylpropyl)-.
Sources
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