- InChI
- InChI=1S/C4H7Cl3/c1-3(5)2-4(6)7/h3-4H,2H2,1H3
- InChI Key
- GSBUVYHAANRCNO-UHFFFAOYSA-N
- Formula
- C4H7Cl3
- SMILES
- CC(Cl)CC(Cl)Cl
- Molecular Weight1
- 161.46
- CAS
- 13279-87-3
- 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).
- 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° | -57.87 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -183.67 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 11.66 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 36.88 | kJ/mol | Joback Calculated Property |
| log10WS | -2.68 | Crippen Calculated Property | |
| logPoct/wat | 2.807 | Crippen Calculated Property | |
| McVol | 103.940 | ml/mol | McGowan Calculated Property |
| Pc | 3472.45 | kPa | Joback Calculated Property |
| Tboil | [423.00; 423.00] | K |
|
| Tboil | 423.00 ± 4.00 | K | NIST |
| Tboil | 423.00 ± 3.00 | K | NIST |
| Tc | 601.91 | K | Joback Calculated Property |
| Tfus | 194.60 | K | Joback Calculated Property |
| Vc | 0.395 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [163.69; 203.87] | J/mol×K | [402.33; 601.91] |
|
| Cp,gas | 163.69 | J/mol×K | 402.33 | Joback Calculated Property |
| Cp,gas | 171.34 | J/mol×K | 435.59 | Joback Calculated Property |
| Cp,gas | 178.58 | J/mol×K | 468.86 | Joback Calculated Property |
| Cp,gas | 185.45 | J/mol×K | 502.12 | Joback Calculated Property |
| Cp,gas | 191.94 | J/mol×K | 535.38 | Joback Calculated Property |
| Cp,gas | 198.08 | J/mol×K | 568.64 | Joback Calculated Property |
| Cp,gas | 203.87 | J/mol×K | 601.91 | Joback Calculated Property |
| η | [0.0003596; 0.0106392] | Pa×s | [194.60; 402.33] |
|
| η | 0.0106392 | Pa×s | 194.60 | Joback Calculated Property |
| η | 0.0039497 | Pa×s | 229.22 | Joback Calculated Property |
| η | 0.0019018 | Pa×s | 263.84 | Joback Calculated Property |
| η | 0.0010849 | Pa×s | 298.47 | Joback Calculated Property |
| η | 0.0006955 | Pa×s | 333.09 | Joback Calculated Property |
| η | 0.0004848 | Pa×s | 367.71 | Joback Calculated Property |
| η | 0.0003596 | Pa×s | 402.33 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,1,3-trichlorobutane.
Sources
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