- InChI
- InChI=1S/C30H50O4/c1-5-6-7-8-9-10-11-12-13-14-15-18-24-33-29(31)27-22-16-17-23-28(27)30(32)34-26(4)21-19-20-25(2)3/h16-17,22-23,25-26H,5-15,18-21,24H2,1-4H3
- InChI Key
- HELDDLOJYXLVRY-UHFFFAOYSA-N
- Formula
- C30H50O4
- SMILES
-
CCCCCCCCCCCCCCOC(=O)c1ccccc1C(
=O)OC(C)CCCC(C)C - Molecular Weight1
- 474.72
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 1.2860 | Relay (1.0) Calculated Property | |
| ΔfG° | -168.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1062.73 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 65.64 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 127.90 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.44 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.27 | Relay (1.0) Calculated Property | |
| logPoct/wat | 8.916 | Crippen Calculated Property | |
| McVol | 424.680 | ml/mol | McGowan Calculated Property |
| Pc | 740.84 | kPa | Joback Calculated Property |
| Inp | [3208.00; 3208.00] |
|
|
| Inp | 3208.00 | NIST | |
| Inp | 3208.00 | NIST | |
| Tboil | 692.03 | K | Relay (1.0) Calculated Property |
| Tc | 896.02 | K | Relay (1.0) Calculated Property |
| Tfus | 280.33 | K | Relay (1.0) Calculated Property |
| Vc | 1.596 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1497.17; 1579.37] | J/mol×K | [1069.16; 1319.32] |
|
| Cp,gas | 1497.17 | J/mol×K | 1069.16 | Joback Calculated Property |
| Cp,gas | 1515.72 | J/mol×K | 1110.85 | Joback Calculated Property |
| Cp,gas | 1532.20 | J/mol×K | 1152.55 | Joback Calculated Property |
| Cp,gas | 1546.71 | J/mol×K | 1194.24 | Joback Calculated Property |
| Cp,gas | 1559.34 | J/mol×K | 1235.93 | Joback Calculated Property |
| Cp,gas | 1570.20 | J/mol×K | 1277.62 | Joback Calculated Property |
| Cp,gas | 1579.37 | J/mol×K | 1319.32 | Joback Calculated Property |
| η | [0.0000101; 0.0002206] | Pa×s | [581.12; 1069.16] |
|
| η | 0.0002206 | Pa×s | 581.12 | Joback Calculated Property |
| η | 0.0000962 | Pa×s | 662.46 | Joback Calculated Property |
| η | 0.0000503 | Pa×s | 743.80 | Joback Calculated Property |
| η | 0.0000299 | Pa×s | 825.14 | Joback Calculated Property |
| η | 0.0000195 | Pa×s | 906.48 | Joback Calculated Property |
| η | 0.0000136 | Pa×s | 987.82 | Joback Calculated Property |
| η | 0.0000101 | Pa×s | 1069.16 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phthalic acid, 6-methylhept-2-yl tetradecyl ester.
Sources
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