- InChI
- InChI=1S/C28H37ClO4/c1-3-4-5-6-7-8-9-10-11-12-15-20-32-27(30)24-16-13-14-17-25(24)28(31)33-26-19-18-23(29)21-22(26)2/h13-14,16-19,21H,3-12,15,20H2,1-2H3
- InChI Key
- SXRPBUATCBSGFC-UHFFFAOYSA-N
- Formula
- C28H37ClO4
- SMILES
-
CCCCCCCCCCCCCOC(=O)c1ccccc1C(=
O)Oc1ccc(Cl)cc1C - 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° | -98.96 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -687.94 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 64.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 107.16 | kJ/mol | Joback Calculated Property |
| log10WS | -9.98 | Crippen Calculated Property | |
| logPoct/wat | 8.335 | Crippen Calculated Property | |
| McVol | 384.980 | ml/mol | McGowan Calculated Property |
| Pc | 956.14 | kPa | Joback Calculated Property |
| Inp | [3440.00; 3440.00] |
|
|
| Inp | 3440.00 | NIST | |
| Inp | 3440.00 | NIST | |
| Tboil | 1098.35 | K | Joback Calculated Property |
| Tc | 1345.45 | K | Joback Calculated Property |
| Tfus | 669.96 | K | Joback Calculated Property |
| Vc | 1.484 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1279.55; 1333.43] | J/mol×K | [1098.35; 1345.45] |
|
| Cp,gas | 1279.55 | J/mol×K | 1098.35 | Joback Calculated Property |
| Cp,gas | 1292.59 | J/mol×K | 1139.53 | Joback Calculated Property |
| Cp,gas | 1303.90 | J/mol×K | 1180.72 | Joback Calculated Property |
| Cp,gas | 1313.56 | J/mol×K | 1221.90 | Joback Calculated Property |
| Cp,gas | 1321.66 | J/mol×K | 1263.08 | Joback Calculated Property |
| Cp,gas | 1328.26 | J/mol×K | 1304.27 | Joback Calculated Property |
| Cp,gas | 1333.43 | J/mol×K | 1345.45 | Joback Calculated Property |
| η | [0.0000154; 0.0001385] | Pa×s | [669.96; 1098.35] |
|
| η | 0.0001385 | Pa×s | 669.96 | Joback Calculated Property |
| η | 0.0000806 | Pa×s | 741.36 | Joback Calculated Property |
| η | 0.0000516 | Pa×s | 812.76 | Joback Calculated Property |
| η | 0.0000355 | Pa×s | 884.16 | Joback Calculated Property |
| η | 0.0000258 | Pa×s | 955.55 | Joback Calculated Property |
| η | 0.0000196 | Pa×s | 1026.95 | Joback Calculated Property |
| η | 0.0000154 | Pa×s | 1098.35 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phthalic acid, 4-chloro-2-methylphenyl tridecyl ester.
Sources
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