- InChI
- InChI=1S/C15H22O4/c1-8(2)12(16)11-14(18-6)9(3)13(17-5)10(4)15(11)19-7/h8H,1-7H3
- InChI Key
- XLMIFOSFHOIPHQ-UHFFFAOYSA-N
- Formula
- C15H22O4
- SMILES
-
COc1c(C)c(OC)c(C(=O)C(C)C)c(OC
)c1C - Molecular Weight1
- 266.33
- 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 | 0.7317 | Relay (1.0) Calculated Property | |
| ΔfG° | -306.68 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -627.04 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 28.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 80.51 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.83 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.85 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.168 | Crippen Calculated Property | |
| McVol | 217.630 | ml/mol | McGowan Calculated Property |
| Pc | 1762.45 | kPa | Joback Calculated Property |
| Inp | 1685.00 | NIST | |
| Tboil | 573.09 | K | Relay (1.0) Calculated Property |
| Tc | 807.15 | K | Relay (1.0) Calculated Property |
| Tfus | 365.94 | K | Relay (1.0) Calculated Property |
| Vc | 0.809 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [600.13; 681.18] | J/mol×K | [714.87; 917.11] | 
|
| Cp,gas | 600.13 | J/mol×K | 714.87 | Joback Calculated Property |
| Cp,gas | 615.86 | J/mol×K | 748.58 | Joback Calculated Property |
| Cp,gas | 630.73 | J/mol×K | 782.28 | Joback Calculated Property |
| Cp,gas | 644.72 | J/mol×K | 815.99 | Joback Calculated Property |
| Cp,gas | 657.81 | J/mol×K | 849.70 | Joback Calculated Property |
| Cp,gas | 669.97 | J/mol×K | 883.40 | Joback Calculated Property |
| Cp,gas | 681.18 | J/mol×K | 917.11 | Joback Calculated Property |
| η | [0.0000755; 0.0004461] | Pa×s | [449.45; 714.87] |
|
| η | 0.0004461 | Pa×s | 449.45 | Joback Calculated Property |
| η | 0.0002905 | Pa×s | 493.69 | Joback Calculated Property |
| η | 0.0002031 | Pa×s | 537.92 | Joback Calculated Property |
| η | 0.0001499 | Pa×s | 582.16 | Joback Calculated Property |
| η | 0.0001155 | Pa×s | 626.40 | Joback Calculated Property |
| η | 0.0000921 | Pa×s | 670.63 | Joback Calculated Property |
| η | 0.0000755 | Pa×s | 714.87 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to apodophyllone.
Sources
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