- InChI
- InChI=1S/C3H6Cl2O/c4-1-3(5)2-6/h3,6H,1-2H2
- InChI Key
- ZXCYIJGIGSDJQQ-UHFFFAOYSA-N
- Formula
- C3H6Cl2O
- SMILES
- OCC(Cl)CCl
- Molecular Weight1
- 128.99
- CAS
- 616-23-9
- Other Names
-
- 1,2-Dichloro-3-propanol
- 1,2-Dichloropropanol-3
- 2,3-Dichloro-1-propanol
- 2,3-Dichloropropanol
- 2,3-dichloropropan-1-ol
- Glycerol «alpha»,«beta»-dichlorohydrin
- Glycerol «alpha»,«beta»-dichlorohydrin
- Glyceryl dichlorohydrin
- «alpha»,«beta»-Dichlorohydrin
- «beta»-Dichlorohydrin
- «alpha»,«beta»-Dichlorohydrin
- «beta»-Dichlorohydrin
- ΔcH°liquid : Standard liquid enthalpy of combustion (kJ/mol).
- 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).
- ΔfH°liquid : Liquid phase 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.
- 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 |
|---|---|---|---|
| ΔcH°liquid | [-1722.96; -1704.00] | kJ/mol |
|
| ΔcH°liquid | -1704.00 ± 1.00 | kJ/mol | NIST |
| ΔcH°liquid | -1722.96 | kJ/mol | NIST |
| ΔfG° | -188.74 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -316.00 ± 4.60 | kJ/mol | NIST |
| ΔfH°liquid | -381.00 ± 2.00 | kJ/mol | NIST |
| ΔfusH° | 12.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 47.33 | kJ/mol | Joback Calculated Property |
| log10WS | -0.76 | Crippen Calculated Property | |
| logPoct/wat | 0.825 | Crippen Calculated Property | |
| McVol | 83.480 | ml/mol | McGowan Calculated Property |
| Pc | 4565.38 | kPa | Joback Calculated Property |
| Inp | [959.00; 959.00] |
|
|
| Inp | 959.00 | NIST | |
| Inp | 959.00 | NIST | |
| Tboil | 456.00 ± 1.00 | K | NIST |
| Tc | 615.83 | K | Joback Calculated Property |
| Tfus | 229.23 | K | Joback Calculated Property |
| Vc | 0.315 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [142.19; 171.37] | J/mol×K | [434.64; 615.83] |
|
| Cp,gas | 142.19 | J/mol×K | 434.64 | Joback Calculated Property |
| Cp,gas | 147.67 | J/mol×K | 464.84 | Joback Calculated Property |
| Cp,gas | 152.89 | J/mol×K | 495.04 | Joback Calculated Property |
| Cp,gas | 157.86 | J/mol×K | 525.23 | Joback Calculated Property |
| Cp,gas | 162.59 | J/mol×K | 555.43 | Joback Calculated Property |
| Cp,gas | 167.09 | J/mol×K | 585.63 | Joback Calculated Property |
| Cp,gas | 171.37 | J/mol×K | 615.83 | Joback Calculated Property |
| η | [0.0003215; 0.0828767] | Pa×s | [229.23; 434.64] |
|
| η | 0.0828767 | Pa×s | 229.23 | Joback Calculated Property |
| η | 0.0180080 | Pa×s | 263.47 | Joback Calculated Property |
| η | 0.0055588 | Pa×s | 297.70 | Joback Calculated Property |
| η | 0.0021867 | Pa×s | 331.94 | Joback Calculated Property |
| η | 0.0010242 | Pa×s | 366.17 | Joback Calculated Property |
| η | 0.0005461 | Pa×s | 400.40 | Joback Calculated Property |
| η | 0.0003215 | Pa×s | 434.64 | Joback Calculated Property |
| ΔvapH | [48.50; 65.30] | kJ/mol | [293.00; 401.50] |
|
| ΔvapH | 65.30 ± 4.20 | kJ/mol | 293.00 | NIST |
| ΔvapH | 48.50 | kJ/mol | 401.50 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.67] | kPa | [341.79; 481.77] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.75789e+01 | |||
| Coefficient B | -5.91000e+03 | |||
| Temperature range, min. | 341.79 | |||
| Temperature range, max. | 481.77 | |||
| Pvap | 1.33 | kPa | 341.79 | Calculated Property |
| Pvap | 2.83 | kPa | 357.34 | Calculated Property |
| Pvap | 5.64 | kPa | 372.90 | Calculated Property |
| Pvap | 10.64 | kPa | 388.45 | Calculated Property |
| Pvap | 19.11 | kPa | 404.00 | Calculated Property |
| Pvap | 32.87 | kPa | 419.56 | Calculated Property |
| Pvap | 54.39 | kPa | 435.11 | Calculated Property |
| Pvap | 86.91 | kPa | 450.66 | Calculated Property |
| Pvap | 134.61 | kPa | 466.22 | Calculated Property |
| Pvap | 202.67 | kPa | 481.77 | Calculated Property |
Similar Compounds
Find more compounds similar to 1-Propanol, 2,3-dichloro-.
Sources
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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