- InChI
- InChI=1S/C23H37ClO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-26-23(25)20-21-15-17-22(24)18-16-21/h15-18H,2-14,19-20H2,1H3
- InChI Key
- RIBKIEWMPDYZQU-UHFFFAOYSA-N
- Formula
- C23H37ClO2
- SMILES
-
CCCCCCCCCCCCCCCOC(=O)Cc1ccc(Cl
)cc1 - 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° | -0.29 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -553.53 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 55.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 83.27 | kJ/mol | Joback Calculated Property |
| log10WS | -8.10 | Crippen Calculated Property | |
| logPoct/wat | 7.517 | Crippen Calculated Property | |
| McVol | 330.850 | ml/mol | McGowan Calculated Property |
| Pc | 1039.91 | kPa | Joback Calculated Property |
| Inp | [2886.00; 2886.00] |
|
|
| Inp | 2886.00 | NIST | |
| Inp | 2886.00 | NIST | |
| Tboil | 871.02 | K | Joback Calculated Property |
| Tc | 1070.81 | K | Joback Calculated Property |
| Tfus | 489.99 | K | Joback Calculated Property |
| Vc | 1.288 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1037.11; 1128.11] | J/mol×K | [871.02; 1070.81] |
|
| Cp,gas | 1037.11 | J/mol×K | 871.02 | Joback Calculated Property |
| Cp,gas | 1054.99 | J/mol×K | 904.32 | Joback Calculated Property |
| Cp,gas | 1071.72 | J/mol×K | 937.62 | Joback Calculated Property |
| Cp,gas | 1087.36 | J/mol×K | 970.92 | Joback Calculated Property |
| Cp,gas | 1101.93 | J/mol×K | 1004.22 | Joback Calculated Property |
| Cp,gas | 1115.50 | J/mol×K | 1037.51 | Joback Calculated Property |
| Cp,gas | 1128.11 | J/mol×K | 1070.81 | Joback Calculated Property |
| η | [0.0000430; 0.0006243] | Pa×s | [489.99; 871.02] |
|
| η | 0.0006243 | Pa×s | 489.99 | Joback Calculated Property |
| η | 0.0003094 | Pa×s | 553.50 | Joback Calculated Property |
| η | 0.0001772 | Pa×s | 617.00 | Joback Calculated Property |
| η | 0.0001126 | Pa×s | 680.50 | Joback Calculated Property |
| η | 0.0000773 | Pa×s | 744.01 | Joback Calculated Property |
| η | 0.0000563 | Pa×s | 807.51 | Joback Calculated Property |
| η | 0.0000430 | Pa×s | 871.02 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phenylacetic acid, 4-chloro-, pentadecyl ester.
Sources
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