- InChI
- InChI=1S/C12H18O4/c1-3-9-15-11(13)7-5-6-8-12(14)16-10-4-2/h3-4H,1-2,5-10H2
- InChI Key
- FPODCVUTIPDRTE-UHFFFAOYSA-N
- Formula
- C12H18O4
- SMILES
- C=CCOC(=O)CCCCC(=O)OCC=C
- Molecular Weight1
- 226.27
- CAS
- 2998-04-1
- Other Names
-
- Adipic acid, diallyl ester
- Allyl adipate
- Diallyl adipate
- Diallylester kyseliny adipove
- Hexanedioic acid, bis(2-propenyl) ester
- Diallyl hexanedioate
- 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° | -242.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -529.75 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 29.85 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 59.28 | kJ/mol | Joback Calculated Property |
| log10WS | -2.28 | Crippen Calculated Property | |
| logPoct/wat | 2.005 | Crippen Calculated Property | |
| McVol | 186.220 | ml/mol | McGowan Calculated Property |
| Pc | 2077.43 | kPa | Joback Calculated Property |
| Inp | [1510.00; 1567.00] |
|
|
| Inp | 1567.00 | NIST | |
| Inp | 1510.00 | NIST | |
| Inp | 1567.00 | NIST | |
| Tboil | 619.90 | K | Joback Calculated Property |
| Tc | 802.73 | K | Joback Calculated Property |
| Tfus | 365.80 | K | Joback Calculated Property |
| Vc | 0.718 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [472.49; 543.71] | J/mol×K | [619.90; 802.73] |
|
| Cp,gas | 472.49 | J/mol×K | 619.90 | Joback Calculated Property |
| Cp,gas | 485.91 | J/mol×K | 650.37 | Joback Calculated Property |
| Cp,gas | 498.71 | J/mol×K | 680.84 | Joback Calculated Property |
| Cp,gas | 510.88 | J/mol×K | 711.31 | Joback Calculated Property |
| Cp,gas | 522.43 | J/mol×K | 741.78 | Joback Calculated Property |
| Cp,gas | 533.37 | J/mol×K | 772.26 | Joback Calculated Property |
| Cp,gas | 543.71 | J/mol×K | 802.73 | Joback Calculated Property |
| η | [0.0001655; 0.0016394] | Pa×s | [365.80; 619.90] |
|
| η | 0.0016394 | Pa×s | 365.80 | Joback Calculated Property |
| η | 0.0009174 | Pa×s | 408.15 | Joback Calculated Property |
| η | 0.0005726 | Pa×s | 450.50 | Joback Calculated Property |
| η | 0.0003875 | Pa×s | 492.85 | Joback Calculated Property |
| η | 0.0002790 | Pa×s | 535.20 | Joback Calculated Property |
| η | 0.0002108 | Pa×s | 577.55 | Joback Calculated Property |
| η | 0.0001655 | Pa×s | 619.90 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Hexanedioic acid, di-2-propenyl ester.
Sources
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