- InChI
- InChI=1S/C15H24Cl2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-19-15(18)14(16)17/h14H,2-10,13H2,1H3
- InChI Key
- DVLQUHLPIXUEAP-UHFFFAOYSA-N
- Formula
- C15H24Cl2O2
- SMILES
- CCCCCCCCCCC#CCOC(=O)C(Cl)Cl
- Molecular Weight1
- 307.26
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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 | 0.7142 | Relay (1.0) Calculated Property | |
| ΔfG° | 18.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -432.42 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 45.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 89.99 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.93 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.97 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.868 | Crippen Calculated Property | |
| McVol | 245.530 | ml/mol | McGowan Calculated Property |
| Pc | 1577.21 | kPa | Joback Calculated Property |
| Inp | [2007.00; 2007.00] |
|
|
| Inp | 2007.00 | NIST | |
| Inp | 2007.00 | NIST | |
| Tboil | 562.40 | K | Relay (1.0) Calculated Property |
| Tc | 786.51 | K | Relay (1.0) Calculated Property |
| Tfus | 287.08 | K | Relay (1.0) Calculated Property |
| Vc | 0.890 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [643.28; 724.43] | J/mol×K | [702.31; 896.67] |
|
| Cp,gas | 643.28 | J/mol×K | 702.31 | Joback Calculated Property |
| Cp,gas | 658.80 | J/mol×K | 734.70 | Joback Calculated Property |
| Cp,gas | 673.50 | J/mol×K | 767.10 | Joback Calculated Property |
| Cp,gas | 687.39 | J/mol×K | 799.49 | Joback Calculated Property |
| Cp,gas | 700.50 | J/mol×K | 831.88 | Joback Calculated Property |
| Cp,gas | 712.84 | J/mol×K | 864.28 | Joback Calculated Property |
| Cp,gas | 724.43 | J/mol×K | 896.67 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dichloroacetic acid, tridec-2-ynyl ester.
Sources
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