- InChI
- InChI=1S/C5H10Cl2O/c1-5(2-6,3-7)4-8/h8H,2-4H2,1H3
- InChI Key
- DOANJBQUOFJQHC-UHFFFAOYSA-N
- Formula
- C5H10Cl2O
- SMILES
- CC(CO)(CCl)CCl
- Molecular Weight1
- 157.04
- Other Names
-
- 1-Propanol, 3-chloro-2-(chloromethyl)-2-methyl-
- 3-chloro-2-(chloromethyl)-2-methylpropan-1-ol
- 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).
- Tboilr : Boiling point at reduced pressure (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 | 0.5858 | Relay (1.0) Calculated Property | |
| ΔfG° | -166.62 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -360.21 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 13.77 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.88 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.01 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.40 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.463 | Crippen Calculated Property | |
| McVol | 111.660 | ml/mol | McGowan Calculated Property |
| Pc | 3624.61 | kPa | Joback Calculated Property |
| Tboil | 486.37 | K | Relay (1.0) Calculated Property |
| Tc | 713.98 | K | Relay (1.0) Calculated Property |
| Tfus | 340.13 | K | Relay (1.0) Calculated Property |
| Vc | 0.378 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [220.58; 264.56] | J/mol×K | [477.81; 662.92] | 
|
| Cp,gas | 220.58 | J/mol×K | 477.81 | Joback Calculated Property |
| Cp,gas | 229.09 | J/mol×K | 508.66 | Joback Calculated Property |
| Cp,gas | 237.09 | J/mol×K | 539.51 | Joback Calculated Property |
| Cp,gas | 244.61 | J/mol×K | 570.36 | Joback Calculated Property |
| Cp,gas | 251.68 | J/mol×K | 601.22 | Joback Calculated Property |
| Cp,gas | 258.32 | J/mol×K | 632.07 | Joback Calculated Property |
| Cp,gas | 264.56 | J/mol×K | 662.92 | Joback Calculated Property |
| η | [0.0002283; 0.0339499] | Pa×s | [269.19; 477.81] |
|
| η | 0.0339499 | Pa×s | 269.19 | Joback Calculated Property |
| η | 0.0091556 | Pa×s | 303.96 | Joback Calculated Property |
| η | 0.0032313 | Pa×s | 338.73 | Joback Calculated Property |
| η | 0.0013845 | Pa×s | 373.50 | Joback Calculated Property |
| η | 0.0006853 | Pa×s | 408.27 | Joback Calculated Property |
| η | 0.0003788 | Pa×s | 443.04 | Joback Calculated Property |
| η | 0.0002283 | Pa×s | 477.81 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 376.70 | K | 1.60 | NIST |
Similar Compounds
Find more compounds similar to 2,2-BIS(CHLOROMETHYL)-1-PROPANOL.
Sources
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