- InChI
- InChI=1S/C28H37ClO4/c1-2-3-4-5-6-7-8-9-10-13-20-32-27(30)25-17-11-12-18-26(25)28(31)33-21-19-23-15-14-16-24(29)22-23/h11-12,14-18,22H,2-10,13,19-21H2,1H3
- InChI Key
- ZZHRZGJDOMXEBB-UHFFFAOYSA-N
- Formula
- C28H37ClO4
- SMILES
-
CCCCCCCCCCCCOC(=O)c1ccccc1C(=O
)OCCc1cccc(Cl)c1 - Molecular Weight1
- 473.04
- 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° | -89.33 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -676.47 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 65.35 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 106.50 | kJ/mol | Joback Calculated Property |
| log10WS | -9.28 | Crippen Calculated Property | |
| logPoct/wat | 7.817 | Crippen Calculated Property | |
| McVol | 384.980 | ml/mol | McGowan Calculated Property |
| Pc | 965.07 | kPa | Joback Calculated Property |
| Inp | [3509.00; 3509.00] |
|
|
| Inp | 3509.00 | NIST | |
| Inp | 3509.00 | NIST | |
| Tboil | 1093.37 | K | Joback Calculated Property |
| Tc | 1339.26 | K | Joback Calculated Property |
| Tfus | 657.44 | K | Joback Calculated Property |
| Vc | 1.484 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1280.99; 1337.67] | J/mol×K | [1093.37; 1339.26] |
|
| Cp,gas | 1280.99 | J/mol×K | 1093.37 | Joback Calculated Property |
| Cp,gas | 1294.29 | J/mol×K | 1134.35 | Joback Calculated Property |
| Cp,gas | 1305.94 | J/mol×K | 1175.33 | Joback Calculated Property |
| Cp,gas | 1316.02 | J/mol×K | 1216.32 | Joback Calculated Property |
| Cp,gas | 1324.61 | J/mol×K | 1257.30 | Joback Calculated Property |
| Cp,gas | 1331.80 | J/mol×K | 1298.28 | Joback Calculated Property |
| Cp,gas | 1337.67 | J/mol×K | 1339.26 | Joback Calculated Property |
| η | [0.0000150; 0.0001517] | Pa×s | [657.44; 1093.37] |
|
| η | 0.0001517 | Pa×s | 657.44 | Joback Calculated Property |
| η | 0.0000851 | Pa×s | 730.10 | Joback Calculated Property |
| η | 0.0000530 | Pa×s | 802.75 | Joback Calculated Property |
| η | 0.0000357 | Pa×s | 875.40 | Joback Calculated Property |
| η | 0.0000256 | Pa×s | 948.06 | Joback Calculated Property |
| η | 0.0000192 | Pa×s | 1020.71 | Joback Calculated Property |
| η | 0.0000150 | Pa×s | 1093.37 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phthalic acid, 2-(3-chlorophenyl)ethyl dodecyl ester.
Sources
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