- InChI
- InChI=1S/C5H11Cl/c1-3-5(6)4-2/h5H,3-4H2,1-2H3
- InChI Key
- CXQSCYIVCSCSES-UHFFFAOYSA-N
- Formula
- C5H11Cl
- SMILES
- CCC(Cl)CC
- Molecular Weight1
- 106.59
- CAS
- 616-20-6
- Other Names
-
- 1-Ethylpropyl chloride
- 3-Chloropentane
- 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (kJ/mol).
- 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).
- Pvap : Vapor pressure (kPa).
- Inp : Non-polar retention indices.
- I : 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 |
|---|---|---|---|
| ΔfG° | -23.15 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -167.55 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 9.38 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 30.72 | kJ/mol | Joback Calculated Property |
| log10WS | -2.63 | Aq. Sol... | |
| logPoct/wat | 2.414 | Crippen Calculated Property | |
| McVol | 93.550 | ml/mol | McGowan Calculated Property |
| Pc | 3352.86 | kPa | Joback Calculated Property |
| Inp | [695.00; 721.00] |
|
|
| Inp | 721.00 | NIST | |
| Inp | 695.00 | NIST | |
| Inp | 721.00 | NIST | |
| Inp | 706.00 | NIST | |
| Inp | 706.00 | NIST | |
| I | [878.00; 900.00] |
|
|
| I | 880.00 | NIST | |
| I | 900.00 | NIST | |
| I | 878.00 | NIST | |
| I | 892.00 | NIST | |
| Tboil | [368.05; 370.94] | K |
|
| Tboil | 370.70 | K | NIST |
| Tboil | 370.65 ± 4.00 | K | NIST |
| Tboil | 370.94 ± 0.30 | K | NIST |
| Tboil | 368.05 ± 2.00 | K | NIST |
| Tc | 527.49 | K | Joback Calculated Property |
| Tfus | [168.00; 168.00] | K |
|
| Tfus | 168.00 ± 2.00 | K | NIST |
| Tfus | 168.00 ± 2.00 | K | NIST |
| Vc | 0.358 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [150.99; 201.54] | J/mol×K | [350.79; 527.49] |
|
| Cp,gas | 150.99 | J/mol×K | 350.79 | Joback Calculated Property |
| Cp,gas | 160.28 | J/mol×K | 380.24 | Joback Calculated Property |
| Cp,gas | 169.22 | J/mol×K | 409.69 | Joback Calculated Property |
| Cp,gas | 177.80 | J/mol×K | 439.14 | Joback Calculated Property |
| Cp,gas | 186.05 | J/mol×K | 468.59 | Joback Calculated Property |
| Cp,gas | 193.96 | J/mol×K | 498.04 | Joback Calculated Property |
| Cp,gas | 201.54 | J/mol×K | 527.49 | Joback Calculated Property |
| η | [0.0002823; 0.0078623] | Pa×s | [161.03; 350.79] |
|
| η | 0.0078623 | Pa×s | 161.03 | Joback Calculated Property |
| η | 0.0028647 | Pa×s | 192.66 | Joback Calculated Property |
| η | 0.0013876 | Pa×s | 224.28 | Joback Calculated Property |
| η | 0.0008040 | Pa×s | 255.91 | Joback Calculated Property |
| η | 0.0005253 | Pa×s | 287.54 | Joback Calculated Property |
| η | 0.0003734 | Pa×s | 319.16 | Joback Calculated Property |
| η | 0.0002823 | Pa×s | 350.79 | Joback Calculated Property |
| ΔvapH | 36.50 | kJ/mol | 349.50 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.65] | kPa | [271.00; 395.78] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.40997e+01 | |||
| Coefficient B | -3.01495e+03 | |||
| Coefficient C | -5.27140e+01 | |||
| Temperature range, min. | 271.00 | |||
| Temperature range, max. | 395.78 | |||
| Pvap | 1.33 | kPa | 271.00 | Calculated Property |
| Pvap | 3.04 | kPa | 284.86 | Calculated Property |
| Pvap | 6.33 | kPa | 298.73 | Calculated Property |
| Pvap | 12.16 | kPa | 312.59 | Calculated Property |
| Pvap | 21.89 | kPa | 326.46 | Calculated Property |
| Pvap | 37.22 | kPa | 340.32 | Calculated Property |
| Pvap | 60.28 | kPa | 354.19 | Calculated Property |
| Pvap | 93.57 | kPa | 368.05 | Calculated Property |
| Pvap | 139.96 | kPa | 381.92 | Calculated Property |
| Pvap | 202.65 | kPa | 395.78 | Calculated Property |
Similar Compounds
Find more compounds similar to Pentane, 3-chloro-.
Sources
- Crippen Method
- Joback Method
- Aqueous Solubility Prediction Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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