- InChI
- InChI=1S/C5H11Cl/c1-3-4-5(2)6/h5H,3-4H2,1-2H3
- InChI Key
- NFRKUDYZEVQXTE-UHFFFAOYSA-N
- Formula
- C5H11Cl
- SMILES
- CCCC(C)Cl
- Molecular Weight1
- 106.59
- CAS
- 625-29-6
- Other Names
-
- 1-Methylbutyl chloride
- 2-Chloropentane
- sec-Amyl chloride
- 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° | [36.00; 36.02] | kJ/mol |
|
| ΔvapH° | 36.02 | kJ/mol | NIST |
| ΔvapH° | 36.00 | kJ/mol | NIST |
| 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 | [686.00; 712.00] |
|
|
| Inp | 712.00 | NIST | |
| Inp | 686.00 | NIST | |
| Inp | 696.00 | NIST | |
| Inp | 712.00 | NIST | |
| Inp | 702.00 | NIST | |
| Inp | 702.00 | NIST | |
| I | [869.00; 884.00] |
|
|
| I | 869.00 | NIST | |
| I | 880.00 | NIST | |
| I | 874.00 | NIST | |
| I | 884.00 | NIST | |
| Tboil | [368.65; 370.01] | K |
|
| Tboil | 368.65 ± 2.00 | K | NIST |
| Tboil | 370.01 ± 0.30 | K | NIST |
| Tboil | 369.85 ± 0.30 | K | NIST |
| Tboil | 369.75 ± 0.30 | K | NIST |
| Tc | 527.49 | K | Joback Calculated Property |
| Tfus | [135.00; 164.65] | K |
|
| Tfus | 164.65 | K | Aq. Sol... |
| Tfus | 135.00 ± 4.00 | 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] |
|
|
T(K) Ideal gas heat capacity (J/mol×K) 150 160 170 180 190 200 350 400 450 500 | ||||
| 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] |
|
|
T(K) Dynamic viscosity (Pa×s) 0 1.00e-3 2.00e-3 3.00e-3 4.00e-3 5.00e-3 6.00e-3 7.00e-3 8.00e-3 200 250 300 350 | ||||
| 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 | [31.90; 36.20] | kJ/mol | [313.00; 368.00] |
|
|
T(K) Enthalpy of vaporization at a given temperature (kJ/mol) 32 33 34 35 36 320 340 360 | ||||
| ΔvapH | 35.20 | kJ/mol | 313.00 | NIST |
| ΔvapH | 34.40 | kJ/mol | 328.00 | NIST |
| ΔvapH | 36.20 | kJ/mol | 349.00 | NIST |
| ΔvapH | 33.50 | kJ/mol | 358.00 | NIST |
| ΔvapH | 31.90 | kJ/mol | 368.00 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.64] | kPa | [269.02; 393.52] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.42868e+01 | |||
| Coefficient B | -3.11391e+03 | |||
| Coefficient C | -4.65810e+01 | |||
| Temperature range, min. | 269.02 | |||
| Temperature range, max. | 393.52 | |||
|
T(K) Vapor pressure (kPa) 0 50 100 150 200 300 350 | ||||
| Pvap | 1.33 | kPa | 269.02 | Calculated Property |
| Pvap | 3.03 | kPa | 282.85 | Calculated Property |
| Pvap | 6.27 | kPa | 296.69 | Calculated Property |
| Pvap | 12.05 | kPa | 310.52 | Calculated Property |
| Pvap | 21.68 | kPa | 324.35 | Calculated Property |
| Pvap | 36.90 | kPa | 338.19 | Calculated Property |
| Pvap | 59.85 | kPa | 352.02 | Calculated Property |
| Pvap | 93.10 | kPa | 365.85 | Calculated Property |
| Pvap | 139.59 | kPa | 379.69 | Calculated Property |
| Pvap | 202.64 | kPa | 393.52 | Calculated Property |
Similar Compounds
Find more compounds similar to Pentane, 2-chloro-.
Sources
- Crippen Method
- Joback Method
- Aqueous Solubility Prediction Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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