- InChI
- InChI=1S/C16H17NO4/c1-19-11-8-9-15(21-3)13(10-11)17-16(18)12-6-4-5-7-14(12)20-2/h4-10H,1-3H3,(H,17,18)
- InChI Key
- UDZQHARUYNSUKH-UHFFFAOYSA-N
- Formula
- C16H17NO4
- SMILES
-
COc1ccc(OC)c(NC(=O)c2ccccc2OC)
c1 - Molecular Weight1
- 287.31
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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° | -74.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -390.69 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 34.37 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 78.16 | kJ/mol | Joback Calculated Property |
| log10WS | -3.81 | Crippen Calculated Property | |
| logPoct/wat | 2.965 | Crippen Calculated Property | |
| McVol | 217.940 | ml/mol | McGowan Calculated Property |
| Pc | 2241.88 | kPa | Joback Calculated Property |
| Inp | 2574.00 | NIST | |
| Tboil | 805.08 | K | Joback Calculated Property |
| Tc | 1032.94 | K | Joback Calculated Property |
| Tfus | 529.76 | K | Joback Calculated Property |
| Vc | 0.810 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [622.08; 686.62] | J/mol×K | [805.08; 1032.94] | 
|
| Cp,gas | 622.08 | J/mol×K | 805.08 | Joback Calculated Property |
| Cp,gas | 635.90 | J/mol×K | 843.06 | Joback Calculated Property |
| Cp,gas | 648.50 | J/mol×K | 881.03 | Joback Calculated Property |
| Cp,gas | 659.87 | J/mol×K | 919.01 | Joback Calculated Property |
| Cp,gas | 670.01 | J/mol×K | 956.99 | Joback Calculated Property |
| Cp,gas | 678.93 | J/mol×K | 994.97 | Joback Calculated Property |
| Cp,gas | 686.62 | J/mol×K | 1032.94 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, N-(2,5-dimethoxyphenyl)-2-methoxy-.
Sources
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