- InChI
- InChI=1S/C5H9Cl3/c1-5(2-6,3-7)4-8/h2-4H2,1H3
- InChI Key
- BYXOMFFBGDPXHB-UHFFFAOYSA-N
- Formula
- C5H9Cl3O
- SMILES
- CC(CCl)(CCl)CCl
- Molecular Weight1
- 191.48
- CAS
- 1067-09-0
- Other Names
-
- 2-Chloromethyl-2-methyl-1,3-dichloropropane
- 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).
- ΔfusH : Enthalpy of fusion at a given temperature (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (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).
- 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° | -41.73 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -202.50 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 13.88 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 38.58 | kJ/mol | Joback Calculated Property |
| log10WS | -2.13 | Crippen Calculated Property | |
| logPoct/wat | 2.709 | Crippen Calculated Property | |
| McVol | 118.030 | ml/mol | McGowan Calculated Property |
| Pc | 3121.00 | kPa | Joback Calculated Property |
| Tboil | 422.86 | K | Joback Calculated Property |
| Tc | 624.33 | K | Joback Calculated Property |
| Tfus | 238.29 | K | Joback Calculated Property |
| Vc | 0.452 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [201.93; 251.02] | J/mol×K | [422.86; 624.33] | 
|
| Cp,gas | 201.93 | J/mol×K | 422.86 | Joback Calculated Property |
| Cp,gas | 211.57 | J/mol×K | 456.44 | Joback Calculated Property |
| Cp,gas | 220.59 | J/mol×K | 490.02 | Joback Calculated Property |
| Cp,gas | 229.01 | J/mol×K | 523.59 | Joback Calculated Property |
| Cp,gas | 236.86 | J/mol×K | 557.17 | Joback Calculated Property |
| Cp,gas | 244.19 | J/mol×K | 590.75 | Joback Calculated Property |
| Cp,gas | 251.02 | J/mol×K | 624.33 | Joback Calculated Property |
| η | [0.0003883; 0.0064698] | Pa×s | [238.29; 422.86] |
|
| η | 0.0064698 | Pa×s | 238.29 | Joback Calculated Property |
| η | 0.0030966 | Pa×s | 269.05 | Joback Calculated Property |
| η | 0.0017240 | Pa×s | 299.81 | Joback Calculated Property |
| η | 0.0010703 | Pa×s | 330.58 | Joback Calculated Property |
| η | 0.0007207 | Pa×s | 361.34 | Joback Calculated Property |
| η | 0.0005164 | Pa×s | 392.10 | Joback Calculated Property |
| η | 0.0003883 | Pa×s | 422.86 | Joback Calculated Property |
| ΔfusH | 2.50 | kJ/mol | 291.30 | NIST |
Similar Compounds
Find more compounds similar to 2-Chloromethyl-1,3-dichloro-2-methylpropane.
Sources
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