- InChI
- InChI=1S/C20H30O3/c1-4-5-6-7-8-9-10-11-18(21)14-12-17-13-15-19(22-2)20(16-17)23-3/h10-11,13,15-16H,4-9,12,14H2,1-3H3/b11-10+
- InChI Key
- ZNOLGYFCFIVHQI-ZHACJKMWSA-N
- Formula
- C20H30O3
- SMILES
-
CCCCCCCC=CC(=O)CCc1ccc(OC)c(OC
)c1 - Molecular Weight1
- 318.45
- CAS
- 863780-79-4
- 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° | -48.03 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -502.34 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 45.00 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.24 | kJ/mol | Joback Calculated Property |
| log10WS | -5.83 | Crippen Calculated Property | |
| logPoct/wat | 5.122 | Crippen Calculated Property | |
| McVol | 277.910 | ml/mol | McGowan Calculated Property |
| Pc | 1316.56 | kPa | Joback Calculated Property |
| Inp | 2533.50 | NIST | |
| Tboil | 796.51 | K | Joback Calculated Property |
| Tc | 993.89 | K | Joback Calculated Property |
| Tfus | 455.93 | K | Joback Calculated Property |
| Vc | 1.069 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [831.32; 919.78] | J/mol×K | [796.51; 993.89] | 
|
| Cp,gas | 831.32 | J/mol×K | 796.51 | Joback Calculated Property |
| Cp,gas | 848.56 | J/mol×K | 829.41 | Joback Calculated Property |
| Cp,gas | 864.76 | J/mol×K | 862.30 | Joback Calculated Property |
| Cp,gas | 879.96 | J/mol×K | 895.20 | Joback Calculated Property |
| Cp,gas | 894.17 | J/mol×K | 928.10 | Joback Calculated Property |
| Cp,gas | 907.44 | J/mol×K | 960.99 | Joback Calculated Property |
| Cp,gas | 919.78 | J/mol×K | 993.89 | Joback Calculated Property |
| η | [0.0000497; 0.0005641] | Pa×s | [455.93; 796.51] |
|
| η | 0.0005641 | Pa×s | 455.93 | Joback Calculated Property |
| η | 0.0003007 | Pa×s | 512.69 | Joback Calculated Property |
| η | 0.0001817 | Pa×s | 569.46 | Joback Calculated Property |
| η | 0.0001203 | Pa×s | 626.22 | Joback Calculated Property |
| η | 0.0000853 | Pa×s | 682.98 | Joback Calculated Property |
| η | 0.0000637 | Pa×s | 739.75 | Joback Calculated Property |
| η | 0.0000497 | Pa×s | 796.51 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (E)-1-(3,4-Dimethoxyphenyl)dodec-4-en-3-one.
Sources
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