- InChI
- InChI=1S/C19H13ClO2/c20-17-10-6-16(7-11-17)19(21)22-18-12-8-15(9-13-18)14-4-2-1-3-5-14/h1-13H
- InChI Key
- FXACSMXPKVBIMF-UHFFFAOYSA-N
- Formula
- C19H13ClO2
- SMILES
-
O=C(Oc1ccc(-c2ccccc2)cc1)c1ccc
(Cl)cc1 - Molecular Weight1
- 308.76
- 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° | 181.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -9.38 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 33.29 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.58 | kJ/mol | Joback Calculated Property |
| log10WS | -6.85 | Crippen Calculated Property | |
| logPoct/wat | 5.226 | Crippen Calculated Property | |
| McVol | 226.970 | ml/mol | McGowan Calculated Property |
| Pc | 2333.78 | kPa | Joback Calculated Property |
| Inp | [2778.00; 2778.00] |
|
|
| Inp | 2778.00 | NIST | |
| Inp | 2778.00 | NIST | |
| Tboil | 837.84 | K | Joback Calculated Property |
| Tc | 1102.95 | K | Joback Calculated Property |
| Tfus | 510.27 | K | Joback Calculated Property |
| Vc | 0.849 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [611.13; 672.23] | J/mol×K | [837.84; 1102.95] |
|
| Cp,gas | 611.13 | J/mol×K | 837.84 | Joback Calculated Property |
| Cp,gas | 624.56 | J/mol×K | 882.02 | Joback Calculated Property |
| Cp,gas | 636.56 | J/mol×K | 926.21 | Joback Calculated Property |
| Cp,gas | 647.24 | J/mol×K | 970.39 | Joback Calculated Property |
| Cp,gas | 656.67 | J/mol×K | 1014.58 | Joback Calculated Property |
| Cp,gas | 664.97 | J/mol×K | 1058.76 | Joback Calculated Property |
| Cp,gas | 672.23 | J/mol×K | 1102.95 | Joback Calculated Property |
| η | [0.0000796; 0.0006004] | Pa×s | [510.27; 837.84] |
|
| η | 0.0006004 | Pa×s | 510.27 | Joback Calculated Property |
| η | 0.0003644 | Pa×s | 564.87 | Joback Calculated Property |
| η | 0.0002415 | Pa×s | 619.46 | Joback Calculated Property |
| η | 0.0001711 | Pa×s | 674.06 | Joback Calculated Property |
| η | 0.0001276 | Pa×s | 728.65 | Joback Calculated Property |
| η | 0.0000991 | Pa×s | 783.25 | Joback Calculated Property |
| η | 0.0000796 | Pa×s | 837.84 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Chlorobenzoic acid, 4-biphenyl ester.
Sources
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