- InChI
- InChI=1S/C23H37ClO2/c1-3-5-6-7-8-9-10-11-12-13-17-20(16-4-2)26-23(25)21-18-14-15-19-22(21)24/h14-15,18-20H,3-13,16-17H2,1-2H3
- InChI Key
- RLHBBBCVZFMPQH-UHFFFAOYSA-N
- Formula
- C23H37ClO2
- SMILES
-
CCCCCCCCCCCCC(CCC)OC(=O)c1cccc
c1Cl - Molecular Weight1
- 380.99
- 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° | -2.73 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -558.81 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 52.44 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.88 | kJ/mol | Joback Calculated Property |
| log10WS | -8.79 | Crippen Calculated Property | |
| logPoct/wat | 7.977 | Crippen Calculated Property | |
| McVol | 330.850 | ml/mol | McGowan Calculated Property |
| Pc | 1045.30 | kPa | Joback Calculated Property |
| Inp | [2479.10; 2479.10] |
|
|
| Inp | 2479.10 | NIST | |
| Inp | 2479.10 | NIST | |
| Tboil | 870.58 | K | Joback Calculated Property |
| Tc | 1071.46 | K | Joback Calculated Property |
| Tfus | 474.99 | K | Joback Calculated Property |
| Vc | 1.282 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1037.58; 1128.72] | J/mol×K | [870.58; 1071.46] |
|
| Cp,gas | 1037.58 | J/mol×K | 870.58 | Joback Calculated Property |
| Cp,gas | 1055.54 | J/mol×K | 904.06 | Joback Calculated Property |
| Cp,gas | 1072.33 | J/mol×K | 937.54 | Joback Calculated Property |
| Cp,gas | 1087.99 | J/mol×K | 971.02 | Joback Calculated Property |
| Cp,gas | 1102.58 | J/mol×K | 1004.50 | Joback Calculated Property |
| Cp,gas | 1116.14 | J/mol×K | 1037.98 | Joback Calculated Property |
| Cp,gas | 1128.72 | J/mol×K | 1071.46 | Joback Calculated Property |
| η | [0.0000393; 0.0007172] | Pa×s | [474.99; 870.58] |
|
| η | 0.0007172 | Pa×s | 474.99 | Joback Calculated Property |
| η | 0.0003291 | Pa×s | 540.92 | Joback Calculated Property |
| η | 0.0001789 | Pa×s | 606.85 | Joback Calculated Property |
| η | 0.0001096 | Pa×s | 672.78 | Joback Calculated Property |
| η | 0.0000732 | Pa×s | 738.72 | Joback Calculated Property |
| η | 0.0000523 | Pa×s | 804.65 | Joback Calculated Property |
| η | 0.0000393 | Pa×s | 870.58 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Chlorobenzoic acid, 4-hexadecyl ester.
Sources
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