- InChI
- InChI=1S/C7H13Cl3/c1-2-3-4-5-6-7(8,9)10/h2-6H2,1H3
- InChI Key
- XQFUVDNFWZHPEJ-UHFFFAOYSA-N
- Formula
- C7H13Cl3
- SMILES
- CCCCCCC(Cl)(Cl)Cl
- Molecular Weight1
- 203.54
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -24.89 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -243.78 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 19.06 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 43.03 | kJ/mol | Joback Calculated Property |
| log10WS | -4.31 | Crippen Calculated Property | |
| logPoct/wat | 4.327 | Crippen Calculated Property | |
| McVol | 146.210 | ml/mol | McGowan Calculated Property |
| Pc | 2545.61 | kPa | Joback Calculated Property |
| Inp | [1151.00; 1151.00] |
|
|
| Inp | 1151.00 | NIST | |
| Inp | 1151.00 | NIST | |
| Tboil | 468.62 | K | Joback Calculated Property |
| Tc | 665.55 | K | Joback Calculated Property |
| Tfus | 260.83 | K | Joback Calculated Property |
| Vc | 0.564 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [280.69; 342.23] | J/mol×K | [468.62; 665.55] |
|
| Cp,gas | 280.69 | J/mol×K | 468.62 | Joback Calculated Property |
| Cp,gas | 292.62 | J/mol×K | 501.44 | Joback Calculated Property |
| Cp,gas | 303.83 | J/mol×K | 534.26 | Joback Calculated Property |
| Cp,gas | 314.36 | J/mol×K | 567.08 | Joback Calculated Property |
| Cp,gas | 324.25 | J/mol×K | 599.91 | Joback Calculated Property |
| Cp,gas | 333.52 | J/mol×K | 632.73 | Joback Calculated Property |
| Cp,gas | 342.23 | J/mol×K | 665.55 | Joback Calculated Property |
| η | [0.0003172; 0.0059448] | Pa×s | [260.83; 468.62] |
|
| η | 0.0059448 | Pa×s | 260.83 | Joback Calculated Property |
| η | 0.0027395 | Pa×s | 295.46 | Joback Calculated Property |
| η | 0.0014852 | Pa×s | 330.09 | Joback Calculated Property |
| η | 0.0009045 | Pa×s | 364.73 | Joback Calculated Property |
| η | 0.0006003 | Pa×s | 399.36 | Joback Calculated Property |
| η | 0.0004254 | Pa×s | 433.99 | Joback Calculated Property |
| η | 0.0003172 | Pa×s | 468.62 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Heptane, 1,1,1-trichloro.
Sources
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