- InChI
- InChI=1S/C3H7ClO/c1-3(4)2-5/h3,5H,2H2,1H3
- InChI Key
- VZIQXGLTRZLBEX-UHFFFAOYSA-N
- Formula
- C3H7ClO
- SMILES
- CC(Cl)CO
- Molecular Weight1
- 94.54
- CAS
- 78-89-7
- Other Names
-
- 1-Hydroxy-2-chloropropane
- 2-Chloro-1-propanol
- 2-Chloropropanol
- 2-Chloropropyl alcohol
- 2-chloropropan-1-ol
- Propylene chlorohydrin
- UN 2611
- «beta»-Chloropropyl alcohol
- 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).
- Pvap : Vapor 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 | 0.5500 | Relay (1.0) Calculated Property | |
| ΔfG° | -176.81 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -319.65 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 8.29 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 53.84 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.83 | eV | Relay (1.0) Calculated Property |
| log10WS | 0.29 | Relay (1.0) Calculated Property | |
| logPoct/wat | 0.606 | Crippen Calculated Property | |
| McVol | 71.240 | ml/mol | McGowan Calculated Property |
| Pc | 4802.50 | kPa | Joback Calculated Property |
| Tboil | 399.34 | K | Relay (1.0) Calculated Property |
| Tc | 616.03 | K | Relay (1.0) Calculated Property |
| Tfus | 204.25 | K | Relay (1.0) Calculated Property |
| Vc | 0.240 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [122.10; 153.19] | J/mol×K | [397.21; 571.23] | 
|
| Cp,gas | 122.10 | J/mol×K | 397.21 | Joback Calculated Property |
| Cp,gas | 127.85 | J/mol×K | 426.21 | Joback Calculated Property |
| Cp,gas | 133.36 | J/mol×K | 455.22 | Joback Calculated Property |
| Cp,gas | 138.64 | J/mol×K | 484.22 | Joback Calculated Property |
| Cp,gas | 143.70 | J/mol×K | 513.23 | Joback Calculated Property |
| Cp,gas | 148.55 | J/mol×K | 542.23 | Joback Calculated Property |
| Cp,gas | 153.19 | J/mol×K | 571.23 | Joback Calculated Property |
| η | [0.0003683; 0.2012782] | Pa×s | [199.31; 397.21] |
|
| η | 0.2012782 | Pa×s | 199.31 | Joback Calculated Property |
| η | 0.0333896 | Pa×s | 232.29 | Joback Calculated Property |
| η | 0.0086584 | Pa×s | 265.28 | Joback Calculated Property |
| η | 0.0030263 | Pa×s | 298.26 | Joback Calculated Property |
| η | 0.0013040 | Pa×s | 331.24 | Joback Calculated Property |
| η | 0.0006545 | Pa×s | 364.23 | Joback Calculated Property |
| η | 0.0003683 | Pa×s | 397.21 | Joback Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [0.89; 202.61] | kPa | [296.15; 377.71] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.58479e+01 | |||
| Coefficient B | -2.52607e+03 | |||
| Coefficient C | -1.37968e+02 | |||
| Temperature range, min. | 296.15 | |||
| Temperature range, max. | 377.71 | |||
| Pvap | 0.89 | kPa | 296.15 | Calculated Property |
| Pvap | 2.10 | kPa | 305.21 | Calculated Property |
| Pvap | 4.57 | kPa | 314.27 | Calculated Property |
| Pvap | 9.21 | kPa | 323.34 | Calculated Property |
| Pvap | 17.39 | kPa | 332.40 | Calculated Property |
| Pvap | 31.01 | kPa | 341.46 | Calculated Property |
| Pvap | 52.65 | kPa | 350.52 | Calculated Property |
| Pvap | 85.59 | kPa | 359.59 | Calculated Property |
| Pvap | 133.93 | kPa | 368.65 | Calculated Property |
| Pvap | 202.61 | kPa | 377.71 | Calculated Property |
Similar Compounds
Find more compounds similar to 1-PROPANOL, 2-CHLORO-.
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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