- InChI
- InChI=1S/C10H12O4/c1-12-7-4-9(13-2)8(6-11)10(5-7)14-3/h4-6H,1-3H3
- InChI Key
- CRBZVDLXAIFERF-UHFFFAOYSA-N
- Formula
- C10H12O4
- SMILES
- COc1cc(OC)c(C=O)c(OC)c1
- Molecular Weight1
- 196.20
- CAS
- 830-79-5
- Other Names
-
- Benzaldehyde, 2,4,6-trimethoxy-
- 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° | -297.68 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -529.85 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.38 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 56.07 | kJ/mol | Joback Calculated Property |
| log10WS | -2.07 | Crippen Calculated Property | |
| logPoct/wat | 1.525 | Crippen Calculated Property | |
| McVol | 147.180 | ml/mol | McGowan Calculated Property |
| Pc | 2862.74 | kPa | Joback Calculated Property |
| Tboil | 585.74 | K | Joback Calculated Property |
| Tc | 792.23 | K | Joback Calculated Property |
| Tfus | 375.13 | K | Joback Calculated Property |
| Vc | 0.558 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [347.43; 411.94] | J/mol×K | [585.74; 792.23] | 
|
| Cp,gas | 347.43 | J/mol×K | 585.74 | Joback Calculated Property |
| Cp,gas | 359.52 | J/mol×K | 620.16 | Joback Calculated Property |
| Cp,gas | 371.11 | J/mol×K | 654.57 | Joback Calculated Property |
| Cp,gas | 382.17 | J/mol×K | 688.99 | Joback Calculated Property |
| Cp,gas | 392.68 | J/mol×K | 723.40 | Joback Calculated Property |
| Cp,gas | 402.61 | J/mol×K | 757.82 | Joback Calculated Property |
| Cp,gas | 411.94 | J/mol×K | 792.23 | Joback Calculated Property |
| η | [0.0001477; 0.0007464] | Pa×s | [375.13; 585.74] |
|
| η | 0.0007464 | Pa×s | 375.13 | Joback Calculated Property |
| η | 0.0005076 | Pa×s | 410.23 | Joback Calculated Property |
| η | 0.0003668 | Pa×s | 445.33 | Joback Calculated Property |
| η | 0.0002780 | Pa×s | 480.44 | Joback Calculated Property |
| η | 0.0002187 | Pa×s | 515.54 | Joback Calculated Property |
| η | 0.0001775 | Pa×s | 550.64 | Joback Calculated Property |
| η | 0.0001477 | Pa×s | 585.74 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,4,6-Trimethoxybenzaldehyde.
Sources
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