- InChI
- InChI=1S/C14H14O4/c1-3-9-17-13(15)11-7-5-6-8-12(11)14(16)18-10-4-2/h3-8H,1-2,9-10H2
- InChI Key
- QUDWYFHPNIMBFC-UHFFFAOYSA-N
- Formula
- C14H14O4
- SMILES
- C=CCOC(=O)c1ccccc1C(=O)OCC=C
- Molecular Weight1
- 246.26
- CAS
- 131-17-9
- Other Names
-
- 1,2-Benzenedicarboxylic acid, 1,2-di-2-propen-1-yl ester
- 1,2-Benzenedicarboxylic acid, di-2-propenyl ester
- Allyl phthalate
- DAP monomer
- Dapon 35
- Dapon R
- Diallyl ester o-phthalic acid
- Diallyl ester of phthalic acid
- Diallylester kyseliny ftalove
- Diallylester phthalic acid
- NCI-C50657
- NSC 7667
- Phthalic acid, diallyl ester
- diprop-2-enyl benzene-1,2-dicarboxylate
- o-Phthalic acid, diallyl ester
- ΔcH°liquid : Standard liquid enthalpy of combustion (kJ/mol).
- 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).
- ΔfH°liquid : Liquid phase 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).
- Tboilr : Boiling point at reduced pressure (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 |
|---|---|---|---|
| ΔcH°liquid | [-6960.10; -6957.60] | kJ/mol |
|
| ΔcH°liquid | -6960.10 | kJ/mol | NIST |
| ΔcH°liquid | -6957.60 ± 7.10 | kJ/mol | NIST |
| ΔfG° | -122.38 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -345.97 | kJ/mol | Joback Calculated Property |
| ΔfH°liquid | [-552.40; -549.80] | kJ/mol |
|
| ΔfH°liquid | -549.80 | kJ/mol | NIST |
| ΔfH°liquid | -552.40 ± 7.10 | kJ/mol | NIST |
| ΔfusH° | 28.68 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.67 | kJ/mol | Joback Calculated Property |
| log10WS | -3.34 | Aq. Sol... | |
| logPoct/wat | 2.372 | Crippen Calculated Property | |
| McVol | 190.640 | ml/mol | McGowan Calculated Property |
| Pc | 2333.78 | kPa | Joback Calculated Property |
| Inp | [1692.00; 1718.00] |
|
|
| Inp | 1698.00 | NIST | |
| Inp | 1708.00 | NIST | |
| Inp | 1718.00 | NIST | |
| Inp | 1708.00 | NIST | |
| Inp | 1711.00 | NIST | |
| Inp | 1712.00 | NIST | |
| Inp | 1713.00 | NIST | |
| Inp | 1713.00 | NIST | |
| Inp | 1714.00 | NIST | |
| Inp | 1714.00 | NIST | |
| Inp | 1714.00 | NIST | |
| Inp | Outlier 1692.00 | NIST | |
| Inp | 1698.00 | NIST | |
| Inp | 1712.00 | NIST | |
| Inp | 1712.00 | NIST | |
| Inp | 1708.00 | NIST | |
| Inp | 1711.00 | NIST | |
| Inp | 1714.00 | NIST | |
| Tboil | 697.32 | K | Joback Calculated Property |
| Tc | 910.28 | K | Joback Calculated Property |
| Tfus | 427.28 | K | Joback Calculated Property |
| Vc | 0.722 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [492.72; 558.95] | J/mol×K | [697.32; 910.28] |
|
|
T(K) Ideal gas heat capacity (J/mol×K) 490 500 510 520 530 540 550 560 700 800 900 | ||||
| Cp,gas | 492.72 | J/mol×K | 697.32 | Joback Calculated Property |
| Cp,gas | 505.90 | J/mol×K | 732.81 | Joback Calculated Property |
| Cp,gas | 518.21 | J/mol×K | 768.31 | Joback Calculated Property |
| Cp,gas | 529.64 | J/mol×K | 803.80 | Joback Calculated Property |
| Cp,gas | 540.24 | J/mol×K | 839.30 | Joback Calculated Property |
| Cp,gas | 550.00 | J/mol×K | 874.79 | Joback Calculated Property |
| Cp,gas | 558.95 | J/mol×K | 910.28 | Joback Calculated Property |
| η | [0.0001321; 0.0009851] | Pa×s | [427.28; 697.32] |
|
|
T(K) Dynamic viscosity (Pa×s) 2.00e-4 4.00e-4 6.00e-4 8.00e-4 1.00e-3 500 600 700 | ||||
| η | 0.0009851 | Pa×s | 427.28 | Joback Calculated Property |
| η | 0.0006008 | Pa×s | 472.29 | Joback Calculated Property |
| η | 0.0003993 | Pa×s | 517.29 | Joback Calculated Property |
| η | 0.0002834 | Pa×s | 562.30 | Joback Calculated Property |
| η | 0.0002116 | Pa×s | 607.31 | Joback Calculated Property |
| η | 0.0001645 | Pa×s | 652.31 | Joback Calculated Property |
| η | 0.0001321 | Pa×s | 697.32 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 439.20 | K | 0.70 | NIST |
Similar Compounds
Find more compounds similar to Diallyl phthalate.
Sources
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