- InChI
- InChI=1S/C29H32O4/c1-2-3-4-5-6-7-13-21-32-28(30)24-17-14-18-25(22-24)29(31)33-27-20-12-11-19-26(27)23-15-9-8-10-16-23/h8-12,14-20,22H,2-7,13,21H2,1H3
- InChI Key
- JZVWVYCGZVCITK-UHFFFAOYSA-N
- Formula
- C29H32O4
- SMILES
-
CCCCCCCCCOC(=O)c1cccc(C(=O)Oc2
ccccc2-c2ccccc2)c1 - Molecular Weight1
- 444.56
- 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° | 43.43 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -444.84 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 57.78 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 106.61 | kJ/mol | Joback Calculated Property |
| log10WS | -9.75 | Crippen Calculated Property | |
| logPoct/wat | 7.480 | Crippen Calculated Property | |
| McVol | 363.070 | ml/mol | McGowan Calculated Property |
| Pc | 1151.44 | kPa | Joback Calculated Property |
| Inp | 3534.00 | NIST | |
| Tboil | 1105.50 | K | Joback Calculated Property |
| Tc | 1354.89 | K | Joback Calculated Property |
| Tfus | 665.21 | K | Joback Calculated Property |
| Vc | 1.383 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1206.37; 1255.42] | J/mol×K | [1105.50; 1354.89] | 
|
| Cp,gas | 1206.37 | J/mol×K | 1105.50 | Joback Calculated Property |
| Cp,gas | 1218.12 | J/mol×K | 1147.06 | Joback Calculated Property |
| Cp,gas | 1228.31 | J/mol×K | 1188.63 | Joback Calculated Property |
| Cp,gas | 1237.03 | J/mol×K | 1230.19 | Joback Calculated Property |
| Cp,gas | 1244.39 | J/mol×K | 1271.76 | Joback Calculated Property |
| Cp,gas | 1250.49 | J/mol×K | 1313.32 | Joback Calculated Property |
| Cp,gas | 1255.42 | J/mol×K | 1354.89 | Joback Calculated Property |
| η | [0.0000161; 0.0001540] | Pa×s | [665.21; 1105.50] |
|
| η | 0.0001540 | Pa×s | 665.21 | Joback Calculated Property |
| η | 0.0000876 | Pa×s | 738.59 | Joback Calculated Property |
| η | 0.0000552 | Pa×s | 811.97 | Joback Calculated Property |
| η | 0.0000376 | Pa×s | 885.36 | Joback Calculated Property |
| η | 0.0000271 | Pa×s | 958.74 | Joback Calculated Property |
| η | 0.0000205 | Pa×s | 1032.12 | Joback Calculated Property |
| η | 0.0000161 | Pa×s | 1105.50 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isophthalic acid, 2-biphenyl nonyl ester.
Sources
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