- InChI
- InChI=1S/C10H10O5/c1-12-8-6(4-11)3-7-9(10(8)13-2)15-5-14-7/h3-4H,5H2,1-2H3
- InChI Key
- GWFYXQGVKQUWFF-UHFFFAOYSA-N
- Formula
- C10H10O5
- SMILES
- COc1c(C=O)cc2c(c1OC)OCO2
- Molecular Weight1
- 210.18
- CAS
- 23731-65-9
- Other Names
-
- 6,7-Dimethoxybenzo[d][1,3]dioxole-5-carbaldehyde
- 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° | -306.09 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -579.96 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 31.83 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 63.56 | kJ/mol | Joback Calculated Property |
| log10WS | -2.16 | Crippen Calculated Property | |
| logPoct/wat | 1.245 | Crippen Calculated Property | |
| McVol | 142.190 | ml/mol | McGowan Calculated Property |
| Pc | 3372.36 | kPa | Joback Calculated Property |
| Inp | [1628.70; 1628.70] |
|
|
| Inp | 1628.70 | NIST | |
| Inp | 1628.70 | NIST | |
| Tboil | 633.61 | K | Joback Calculated Property |
| Tc | 853.92 | K | Joback Calculated Property |
| Tfus | 440.74 | K | Joback Calculated Property |
| Vc | 0.540 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [360.78; 418.24] | J/mol×K | [633.61; 853.92] |
|
| Cp,gas | 360.78 | J/mol×K | 633.61 | Joback Calculated Property |
| Cp,gas | 371.93 | J/mol×K | 670.33 | Joback Calculated Property |
| Cp,gas | 382.44 | J/mol×K | 707.05 | Joback Calculated Property |
| Cp,gas | 392.31 | J/mol×K | 743.76 | Joback Calculated Property |
| Cp,gas | 401.56 | J/mol×K | 780.48 | Joback Calculated Property |
| Cp,gas | 410.20 | J/mol×K | 817.20 | Joback Calculated Property |
| Cp,gas | 418.24 | J/mol×K | 853.92 | Joback Calculated Property |
| η | [0.0003578; 0.0011599] | Pa×s | [440.74; 633.61] |
|
| η | 0.0011599 | Pa×s | 440.74 | Joback Calculated Property |
| η | 0.0008920 | Pa×s | 472.88 | Joback Calculated Property |
| η | 0.0007093 | Pa×s | 505.03 | Joback Calculated Property |
| η | 0.0005797 | Pa×s | 537.17 | Joback Calculated Property |
| η | 0.0004847 | Pa×s | 569.32 | Joback Calculated Property |
| η | 0.0004131 | Pa×s | 601.47 | Joback Calculated Property |
| η | 0.0003578 | Pa×s | 633.61 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 6,7-Dimethoxy-2H-1,3-benzodioxole-5-carbaldehyde.
Sources
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