- InChI
- InChI=1S/C16H18O4/c1-3-5-11-19-15(17)13-9-7-8-10-14(13)16(18)20-12-6-4-2/h3-4,7-10H,1-2,5-6,11-12H2
- InChI Key
- PHSVKLDVWSRDNM-UHFFFAOYSA-N
- Formula
- C16H18O4
- SMILES
- C=CCCOC(=O)c1ccccc1C(=O)OCCC=C
- Molecular Weight1
- 274.31
- Other Names
-
- 1,2-Benzenedicarboxylic acid, dibut-3-enyl ester
- Dibut-3-enyl-1,2-benzenedicarboxylate
- 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° | -105.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -387.25 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 33.86 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.12 | kJ/mol | Joback Calculated Property |
| log10WS | -4.18 | Crippen Calculated Property | |
| logPoct/wat | 3.152 | Crippen Calculated Property | |
| McVol | 218.820 | ml/mol | McGowan Calculated Property |
| Pc | 1954.41 | kPa | Joback Calculated Property |
| Inp | [1939.00; 1939.00] |
|
|
| Inp | 1939.00 | NIST | |
| Inp | 1939.00 | NIST | |
| Tboil | 743.08 | K | Joback Calculated Property |
| Tc | 950.66 | K | Joback Calculated Property |
| Tfus | 449.82 | K | Joback Calculated Property |
| Vc | 0.834 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [598.61; 669.08] | J/mol×K | [743.08; 950.66] |
|
| Cp,gas | 598.61 | J/mol×K | 743.08 | Joback Calculated Property |
| Cp,gas | 612.64 | J/mol×K | 777.68 | Joback Calculated Property |
| Cp,gas | 625.73 | J/mol×K | 812.27 | Joback Calculated Property |
| Cp,gas | 637.90 | J/mol×K | 846.87 | Joback Calculated Property |
| Cp,gas | 649.17 | J/mol×K | 881.46 | Joback Calculated Property |
| Cp,gas | 659.55 | J/mol×K | 916.06 | Joback Calculated Property |
| Cp,gas | 669.08 | J/mol×K | 950.66 | Joback Calculated Property |
| η | [0.0001047; 0.0008637] | Pa×s | [449.82; 743.08] |
|
| η | 0.0008637 | Pa×s | 449.82 | Joback Calculated Property |
| η | 0.0005114 | Pa×s | 498.70 | Joback Calculated Property |
| η | 0.0003325 | Pa×s | 547.57 | Joback Calculated Property |
| η | 0.0002320 | Pa×s | 596.45 | Joback Calculated Property |
| η | 0.0001709 | Pa×s | 645.33 | Joback Calculated Property |
| η | 0.0001315 | Pa×s | 694.20 | Joback Calculated Property |
| η | 0.0001047 | Pa×s | 743.08 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dibut-3-enyl phthalate.
Sources
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