- InChI
- InChI=1S/C19H22O4/c1-4-21-16-13-18(23-6-3)17(22-5-2)12-15(16)19(20)14-10-8-7-9-11-14/h7-13H,4-6H2,1-3H3
- InChI Key
- ATJSQHQJQSASKB-UHFFFAOYSA-N
- Formula
- C19H22O4
- SMILES
-
CCOc1cc(OCC)c(C(=O)c2ccccc2)cc
1OCC - Molecular Weight1
- 314.38
- CAS
- 52199-46-9
- Other Names
-
- Methanone, phenyl(2,4,5-triethoxyphenyl)-
- 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° | -138.89 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -506.08 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.04 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 78.40 | kJ/mol | Joback Calculated Property |
| log10WS | -5.04 | Crippen Calculated Property | |
| logPoct/wat | 4.114 | Crippen Calculated Property | |
| McVol | 250.230 | ml/mol | McGowan Calculated Property |
| Pc | 1717.45 | kPa | Joback Calculated Property |
| Tboil | 823.55 | K | Joback Calculated Property |
| Tc | 1043.55 | K | Joback Calculated Property |
| Tfus | 510.91 | K | Joback Calculated Property |
| Vc | 0.944 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [735.74; 808.76] | J/mol×K | [823.55; 1043.55] | 
|
| Cp,gas | 735.74 | J/mol×K | 823.55 | Joback Calculated Property |
| Cp,gas | 751.08 | J/mol×K | 860.22 | Joback Calculated Property |
| Cp,gas | 765.14 | J/mol×K | 896.88 | Joback Calculated Property |
| Cp,gas | 777.93 | J/mol×K | 933.55 | Joback Calculated Property |
| Cp,gas | 789.46 | J/mol×K | 970.21 | Joback Calculated Property |
| Cp,gas | 799.74 | J/mol×K | 1006.88 | Joback Calculated Property |
| Cp,gas | 808.76 | J/mol×K | 1043.55 | Joback Calculated Property |
| η | [0.0000512; 0.0003600] | Pa×s | [510.91; 823.55] |
|
| η | 0.0003600 | Pa×s | 510.91 | Joback Calculated Property |
| η | 0.0002237 | Pa×s | 563.02 | Joback Calculated Property |
| η | 0.0001507 | Pa×s | 615.12 | Joback Calculated Property |
| η | 0.0001080 | Pa×s | 667.23 | Joback Calculated Property |
| η | 0.0000812 | Pa×s | 719.34 | Joback Calculated Property |
| η | 0.0000635 | Pa×s | 771.44 | Joback Calculated Property |
| η | 0.0000512 | Pa×s | 823.55 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,4,5-Triethoxybenzophenone.
Sources
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