- InChI
- InChI=1S/C16H31ClO2/c1-3-5-6-7-8-9-10-11-12-13-14-19-16(18)15(17)4-2/h15H,3-14H2,1-2H3
- InChI Key
- RYGXUTLSVVTWHR-UHFFFAOYSA-N
- Formula
- C16H31ClO2
- SMILES
- CCCCCCCCCCCCOC(=O)C(Cl)CC
- Molecular Weight1
- 290.87
- Other Names
-
- Butanoic acid, 2-chloro, dodecyl ester
- 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° | -164.45 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -639.39 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 40.66 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.36 | kJ/mol | Joback Calculated Property |
| log10WS | -5.65 | Crippen Calculated Property | |
| logPoct/wat | 5.468 | Crippen Calculated Property | |
| McVol | 255.980 | ml/mol | McGowan Calculated Property |
| Pc | 1334.91 | kPa | Joback Calculated Property |
| Inp | [1905.00; 1922.00] |
|
|
| Inp | 1905.00 | NIST | |
| Inp | 1913.00 | NIST | |
| Inp | 1920.00 | NIST | |
| Inp | 1922.00 | NIST | |
| Inp | 1922.00 | NIST | |
| Inp | 1922.00 | NIST | |
| Inp | 1905.00 | NIST | |
| Inp | 1922.00 | NIST | |
| Tboil | 678.76 | K | Joback Calculated Property |
| Tc | 853.20 | K | Joback Calculated Property |
| Tfus | 357.16 | K | Joback Calculated Property |
| Vc | 0.999 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [711.02; 803.46] | J/mol×K | [678.76; 853.20] |
|
| Cp,gas | 711.02 | J/mol×K | 678.76 | Joback Calculated Property |
| Cp,gas | 728.39 | J/mol×K | 707.83 | Joback Calculated Property |
| Cp,gas | 744.94 | J/mol×K | 736.91 | Joback Calculated Property |
| Cp,gas | 760.71 | J/mol×K | 765.98 | Joback Calculated Property |
| Cp,gas | 775.70 | J/mol×K | 795.05 | Joback Calculated Property |
| Cp,gas | 789.95 | J/mol×K | 824.12 | Joback Calculated Property |
| Cp,gas | 803.46 | J/mol×K | 853.20 | Joback Calculated Property |
| η | [0.0001020; 0.0024442] | Pa×s | [357.16; 678.76] |
|
| η | 0.0024442 | Pa×s | 357.16 | Joback Calculated Property |
| η | 0.0010191 | Pa×s | 410.76 | Joback Calculated Property |
| η | 0.0005200 | Pa×s | 464.36 | Joback Calculated Property |
| η | 0.0003050 | Pa×s | 517.96 | Joback Calculated Property |
| η | 0.0001977 | Pa×s | 571.56 | Joback Calculated Property |
| η | 0.0001380 | Pa×s | 625.16 | Joback Calculated Property |
| η | 0.0001020 | Pa×s | 678.76 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dodecyl 2-chlorobutanoate.
Sources
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