- InChI
- InChI=1S/C7H10Cl4O2/c1-2-3-4-5(8)13-6(12)7(9,10)11/h5H,2-4H2,1H3
- InChI Key
- IDLLIMVVVSVZIT-UHFFFAOYSA-N
- Formula
- C7H10Cl4O2
- SMILES
- CCCCC(Cl)OC(=O)C(Cl)(Cl)Cl
- Molecular Weight1
- 267.96
- Other Names
-
- 1-Pentanol, 1-chloro, trichloroacetate
- 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.
- I : 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° | -273.18 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -509.60 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 22.52 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 56.19 | kJ/mol | Joback Calculated Property |
| log10WS | -3.94 | Crippen Calculated Property | |
| logPoct/wat | 3.655 | Crippen Calculated Property | |
| McVol | 165.890 | ml/mol | McGowan Calculated Property |
| Pc | 2589.85 | kPa | Joback Calculated Property |
| Inp | [1296.00; 1338.00] |
|
|
| Inp | 1296.00 | NIST | |
| Inp | 1333.00 | NIST | |
| Inp | 1338.00 | NIST | |
| Inp | 1338.00 | NIST | |
| I | [1729.00; 1756.00] |
|
|
| I | 1733.00 | NIST | |
| I | 1729.00 | NIST | |
| I | 1736.00 | NIST | |
| I | 1756.00 | NIST | |
| Tboil | 581.90 | K | Joback Calculated Property |
| Tc | 795.32 | K | Joback Calculated Property |
| Tfus | 347.91 | K | Joback Calculated Property |
| Vc | 0.630 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [342.31; 392.66] | J/mol×K | [581.90; 795.32] |
|
| Cp,gas | 342.31 | J/mol×K | 581.90 | Joback Calculated Property |
| Cp,gas | 352.30 | J/mol×K | 617.47 | Joback Calculated Property |
| Cp,gas | 361.62 | J/mol×K | 653.04 | Joback Calculated Property |
| Cp,gas | 370.28 | J/mol×K | 688.61 | Joback Calculated Property |
| Cp,gas | 378.32 | J/mol×K | 724.18 | Joback Calculated Property |
| Cp,gas | 385.77 | J/mol×K | 759.75 | Joback Calculated Property |
| Cp,gas | 392.66 | J/mol×K | 795.32 | Joback Calculated Property |
| η | [0.0002097; 0.0029975] | Pa×s | [347.91; 581.90] |
|
| η | 0.0029975 | Pa×s | 347.91 | Joback Calculated Property |
| η | 0.0015388 | Pa×s | 386.91 | Joback Calculated Property |
| η | 0.0008926 | Pa×s | 425.91 | Joback Calculated Property |
| η | 0.0005673 | Pa×s | 464.90 | Joback Calculated Property |
| η | 0.0003867 | Pa×s | 503.90 | Joback Calculated Property |
| η | 0.0002785 | Pa×s | 542.90 | Joback Calculated Property |
| η | 0.0002097 | Pa×s | 581.90 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-chloropentyl trichloroacetate.
Sources
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