- InChI
- InChI=1S/C10H18Cl2O2/c1-3-4-5-6-7-9(13)14-10(2,12)8-11/h3-8H2,1-2H3
- InChI Key
- FPZTZMYOEFDHBQ-UHFFFAOYSA-N
- Formula
- C10H18Cl2O2
- SMILES
- CCCCCCC(=O)OC(C)(Cl)CCl
- Molecular Weight1
- 241.16
- 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).
- 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 |
|---|---|---|---|
| ω | 0.6114 | Relay (1.0) Calculated Property | |
| ΔfG° | -221.62 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -666.56 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 25.42 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 63.92 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.25 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.40 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.694 | Crippen Calculated Property | |
| McVol | 183.680 | ml/mol | McGowan Calculated Property |
| Pc | 2090.75 | kPa | Joback Calculated Property |
| Inp | [1512.00; 1512.00] |
|
|
| Inp | 1512.00 | NIST | |
| Inp | 1512.00 | NIST | |
| Tboil | 515.92 | K | Relay (1.0) Calculated Property |
| Tc | 716.23 | K | Relay (1.0) Calculated Property |
| Tfus | 231.91 | K | Relay (1.0) Calculated Property |
| Vc | 0.681 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [430.68; 502.48] | J/mol×K | [576.12; 768.12] |
|
| Cp,gas | 430.68 | J/mol×K | 576.12 | Joback Calculated Property |
| Cp,gas | 444.40 | J/mol×K | 608.12 | Joback Calculated Property |
| Cp,gas | 457.38 | J/mol×K | 640.12 | Joback Calculated Property |
| Cp,gas | 469.65 | J/mol×K | 672.12 | Joback Calculated Property |
| Cp,gas | 481.24 | J/mol×K | 704.12 | Joback Calculated Property |
| Cp,gas | 492.18 | J/mol×K | 736.12 | Joback Calculated Property |
| Cp,gas | 502.48 | J/mol×K | 768.12 | Joback Calculated Property |
| η | [0.0001877; 0.0028380] | Pa×s | [336.88; 576.12] |
|
| η | 0.0028380 | Pa×s | 336.88 | Joback Calculated Property |
| η | 0.0014203 | Pa×s | 376.75 | Joback Calculated Property |
| η | 0.0008115 | Pa×s | 416.63 | Joback Calculated Property |
| η | 0.0005113 | Pa×s | 456.50 | Joback Calculated Property |
| η | 0.0003469 | Pa×s | 496.37 | Joback Calculated Property |
| η | 0.0002494 | Pa×s | 536.25 | Joback Calculated Property |
| η | 0.0001877 | Pa×s | 576.12 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,3-Dichloroisopropyl heptanoate.
Sources
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