- InChI
- InChI=1S/C14H18O4/c1-3-4-7-10-18-14(16)12-9-6-5-8-11(12)13(15)17-2/h5-6,8-9H,3-4,7,10H2,1-2H3
- InChI Key
- LVBQLVTVWRWWMG-UHFFFAOYSA-N
- Formula
- C14H18O4
- SMILES
- CCCCCOC(=O)c1ccccc1C(=O)OC
- Molecular Weight1
- 250.29
- Other Names
-
- 1,2-Benzenedicarboxylic acid, pentyl methyl ester
- 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 | 0.7695 | Relay (1.0) Calculated Property | |
| ΔfG° | -298.06 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -681.79 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 31.24 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 80.51 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.22 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.98 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.820 | Crippen Calculated Property | |
| McVol | 199.240 | ml/mol | McGowan Calculated Property |
| Pc | 2155.30 | kPa | Joback Calculated Property |
| Inp | 1836.00 | NIST | |
| Tboil | 582.72 | K | Relay (1.0) Calculated Property |
| Tc | 782.64 | K | Relay (1.0) Calculated Property |
| Tfus | 259.92 | K | Relay (1.0) Calculated Property |
| Vc | 0.742 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [539.98; 612.97] | J/mol×K | [703.96; 909.90] | 
|
| Cp,gas | 539.98 | J/mol×K | 703.96 | Joback Calculated Property |
| Cp,gas | 554.36 | J/mol×K | 738.28 | Joback Calculated Property |
| Cp,gas | 567.84 | J/mol×K | 772.61 | Joback Calculated Property |
| Cp,gas | 580.44 | J/mol×K | 806.93 | Joback Calculated Property |
| Cp,gas | 592.16 | J/mol×K | 841.25 | Joback Calculated Property |
| Cp,gas | 603.00 | J/mol×K | 875.58 | Joback Calculated Property |
| Cp,gas | 612.97 | J/mol×K | 909.90 | Joback Calculated Property |
| η | [0.0001192; 0.0009874] | Pa×s | [430.80; 703.96] |
|
| η | 0.0009874 | Pa×s | 430.80 | Joback Calculated Property |
| η | 0.0005866 | Pa×s | 476.33 | Joback Calculated Property |
| η | 0.0003816 | Pa×s | 521.85 | Joback Calculated Property |
| η | 0.0002660 | Pa×s | 567.38 | Joback Calculated Property |
| η | 0.0001956 | Pa×s | 612.91 | Joback Calculated Property |
| η | 0.0001501 | Pa×s | 658.43 | Joback Calculated Property |
| η | 0.0001192 | Pa×s | 703.96 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Methyl pentyl phthalate.
Sources
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