- InChI
- InChI=1S/C10H20/c1-3-4-7-10-8-5-6-9(10)2/h9-10H,3-8H2,1-2H3
- InChI Key
- CBGQSQYVGVKUCW-UHFFFAOYSA-N
- Formula
- C10H20
- SMILES
- CCCCC1CCCC1C
- Molecular Weight1
- 140.27
- 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).
- 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 | 0.3467 | Relay (1.0) Calculated Property | |
| ΔfG° | 62.16 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -190.47 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 16.66 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 49.55 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.35 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 3.613 | Crippen Calculated Property | |
| McVol | 140.900 | ml/mol | McGowan Calculated Property |
| Pc | 2424.27 | kPa | Joback Calculated Property |
| Inp | 1007.00 | NIST | |
| Tboil | 445.98 | K | Relay (1.0) Calculated Property |
| Tc | 641.20 | K | Relay (1.0) Calculated Property |
| Tfus | 167.01 | K | Relay (1.0) Calculated Property |
| Vc | 0.514 | m3/kmol | Relay (1.0) Calculated Property |
Cheméo can also estimate Log10 of Water solubility in mol/l for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [186.66; 525.19] | 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 | -6.07470e+01 | |||
| Coefficient B | 1.05904e+00 | |||
| Coefficient C | -5.92200e-04 | |||
| Coefficient D | 1.19100e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 186.66 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 245.07 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 297.41 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 344.04 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 385.35 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 421.71 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 453.50 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 481.09 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 504.86 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 525.19 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0030012; 0.0003025] | Pa×s | [209.12; 439.63] |
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 | -1.01854e+01 | |||
| Coefficient B | 9.15250e+02 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 209.12 | |||
| Temperature range, max. | 439.63 | |||
| η | 0.0030012 | Pa×s | 209.12 | Calculated Property |
| η | 0.0018616 | Pa×s | 234.73 | Calculated Property |
| η | 0.0012685 | Pa×s | 260.34 | Calculated Property |
| η | 0.0009259 | Pa×s | 285.96 | Calculated Property |
| η | 0.0007117 | Pa×s | 311.57 | Calculated Property |
| η | 0.0005694 | Pa×s | 337.18 | Calculated Property |
| η | 0.0004701 | Pa×s | 362.79 | Calculated Property |
| η | 0.0003980 | Pa×s | 388.40 | Calculated Property |
| η | 0.0003440 | Pa×s | 414.01 | Calculated Property |
| η | 0.0003025 | Pa×s | 439.63 | Calculated Property |
Similar Compounds
Find more compounds similar to Cyclopentane, 1-butyl-2-methyl.
Sources
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