- InChI
- InChI=1S/C9H16O3/c1-5-7-11-9(3,10-4)12-8-6-2/h5-8H,1-4H3/b7-5+,8-6+
- InChI Key
- OKCRPXLGUMMWRB-KQQUZDAGSA-N
- Formula
- C9H16O3
- SMILES
- CC=COC(C)(OC)OC=CC
- Molecular Weight1
- 172.22
- CAS
- 66178-23-2
- 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).
- 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° | -126.82 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -400.06 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 15.62 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 41.48 | kJ/mol | Joback Calculated Property |
| log10WS | -2.65 | Crippen Calculated Property | |
| logPoct/wat | 2.407 | Crippen Calculated Property | |
| McVol | 146.680 | ml/mol | McGowan Calculated Property |
| Pc | 2475.19 | kPa | Joback Calculated Property |
| Tboil | 477.67 | K | Joback Calculated Property |
| Tc | 667.08 | K | Joback Calculated Property |
| Tfus | 250.14 | K | Joback Calculated Property |
| Vc | 0.542 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [320.22; 394.46] | J/mol×K | [477.67; 667.08] | 
|
| Cp,gas | 320.22 | J/mol×K | 477.67 | Joback Calculated Property |
| Cp,gas | 334.14 | J/mol×K | 509.24 | Joback Calculated Property |
| Cp,gas | 347.41 | J/mol×K | 540.81 | Joback Calculated Property |
| Cp,gas | 360.06 | J/mol×K | 572.37 | Joback Calculated Property |
| Cp,gas | 372.11 | J/mol×K | 603.94 | Joback Calculated Property |
| Cp,gas | 383.57 | J/mol×K | 635.51 | Joback Calculated Property |
| Cp,gas | 394.46 | J/mol×K | 667.08 | Joback Calculated Property |
| η | [0.0001059; 0.0027854] | Pa×s | [250.14; 477.67] |
|
| η | 0.0027854 | Pa×s | 250.14 | Joback Calculated Property |
| η | 0.0011283 | Pa×s | 288.06 | Joback Calculated Property |
| η | 0.0005640 | Pa×s | 325.98 | Joback Calculated Property |
| η | 0.0003257 | Pa×s | 363.90 | Joback Calculated Property |
| η | 0.0002087 | Pa×s | 401.83 | Joback Calculated Property |
| η | 0.0001443 | Pa×s | 439.75 | Joback Calculated Property |
| η | 0.0001059 | Pa×s | 477.67 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (E,E) Di-1-propenyl methyl orthoacetate.
Sources
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