- InChI
- InChI=1S/C5H10Cl2/c1-4(6)3-5(2)7/h4-5H,3H2,1-2H3/t4-,5-/m0/s1
- InChI Key
- DYGOBGYJRRKFEN-WHFBIAKZSA-N
- Formula
- C5H10Cl2
- SMILES
- CC(Cl)CC(C)Cl
- Molecular Weight1
- 141.04
- CAS
- 1625-67-8
- 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 | 0.3379 | Relay (1.0) Calculated Property | |
| ΔfG° | -37.52 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -214.34 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 10.05 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 45.76 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.24 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.82 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.631 | Crippen Calculated Property | |
| McVol | 105.790 | ml/mol | McGowan Calculated Property |
| Pc | 3243.03 | kPa | Joback Calculated Property |
| Tboil | 415.86 | K | Relay (1.0) Calculated Property |
| Tc | 605.63 | K | Relay (1.0) Calculated Property |
| Tfus | 215.28 | K | Relay (1.0) Calculated Property |
| Vc | 0.385 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [137.73; 294.90] | 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 | 2.07610e+01 | |||
| Coefficient B | 5.04240e-01 | |||
| Coefficient C | -2.95400e-04 | |||
| Coefficient D | 6.53000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 137.73 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 165.07 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 189.46 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 211.10 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 230.21 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 246.98 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 261.63 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 274.36 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 285.39 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 294.90 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0132129; 0.0002803] | Pa×s | [175.95; 404.63] |
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 | -1.11439e+01 | |||
| Coefficient B | 1.19952e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 175.95 | |||
| Temperature range, max. | 404.63 | |||
| η | 0.0132129 | Pa×s | 175.95 | Calculated Property |
| η | 0.0055896 | Pa×s | 201.36 | Calculated Property |
| η | 0.0028674 | Pa×s | 226.77 | Calculated Property |
| η | 0.0016828 | Pa×s | 252.18 | Calculated Property |
| η | 0.0010888 | Pa×s | 277.59 | Calculated Property |
| η | 0.0007578 | Pa×s | 303.00 | Calculated Property |
| η | 0.0005579 | Pa×s | 328.41 | Calculated Property |
| η | 0.0004291 | Pa×s | 353.82 | Calculated Property |
| η | 0.0003419 | Pa×s | 379.23 | Calculated Property |
| η | 0.0002803 | Pa×s | 404.63 | Calculated Property |
Similar Compounds
Find more compounds similar to Pentane, 2,4-dichloro-, (R*,R*)-(±)-.
Sources
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