- InChI
- InChI=1S/C24H39ClO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-21-27-24(26)22-19-16-17-20-23(22)25/h16-17,19-20H,2-15,18,21H2,1H3
- InChI Key
- BODQEIRZCIRWTL-UHFFFAOYSA-N
- Formula
- C24H39ClO2
- SMILES
-
CCCCCCCCCCCCCCCCCOC(=O)c1ccccc
1Cl - Molecular Weight1
- 395.02
- 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° | 8.13 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -574.17 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 58.55 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 85.50 | kJ/mol | Joback Calculated Property |
| log10WS | -9.10 | Crippen Calculated Property | |
| logPoct/wat | 8.368 | Crippen Calculated Property | |
| McVol | 344.940 | ml/mol | McGowan Calculated Property |
| Pc | 978.40 | kPa | Joback Calculated Property |
| Inp | [2674.30; 2674.30] |
|
|
| Inp | 2674.30 | NIST | |
| Inp | 2674.30 | NIST | |
| Tboil | 893.90 | K | Joback Calculated Property |
| Tc | 1096.46 | K | Joback Calculated Property |
| Tfus | 501.26 | K | Joback Calculated Property |
| Vc | 1.345 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1098.56; 1190.73] | J/mol×K | [893.90; 1096.46] |
|
| Cp,gas | 1098.56 | J/mol×K | 893.90 | Joback Calculated Property |
| Cp,gas | 1116.74 | J/mol×K | 927.66 | Joback Calculated Property |
| Cp,gas | 1133.72 | J/mol×K | 961.42 | Joback Calculated Property |
| Cp,gas | 1149.56 | J/mol×K | 995.18 | Joback Calculated Property |
| Cp,gas | 1164.31 | J/mol×K | 1028.94 | Joback Calculated Property |
| Cp,gas | 1178.02 | J/mol×K | 1062.70 | Joback Calculated Property |
| Cp,gas | 1190.73 | J/mol×K | 1096.46 | Joback Calculated Property |
| η | [0.0000371; 0.0005578] | Pa×s | [501.26; 893.90] |
|
| η | 0.0005578 | Pa×s | 501.26 | Joback Calculated Property |
| η | 0.0002736 | Pa×s | 566.70 | Joback Calculated Property |
| η | 0.0001555 | Pa×s | 632.14 | Joback Calculated Property |
| η | 0.0000983 | Pa×s | 697.58 | Joback Calculated Property |
| η | 0.0000672 | Pa×s | 763.02 | Joback Calculated Property |
| η | 0.0000488 | Pa×s | 828.46 | Joback Calculated Property |
| η | 0.0000371 | Pa×s | 893.90 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Chlorobenzoic acid, heptadecyl ester.
Sources
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