- InChI
- InChI=1S/C15H23NO3/c1-3-4-5-6-7-12-19-15(17)16-13-8-10-14(18-2)11-9-13/h8-11H,3-7,12H2,1-2H3,(H,16,17)
- InChI Key
- TWIZDGKNGTYUQK-UHFFFAOYSA-N
- Formula
- C15H23NO3
- SMILES
- CCCCCCCOC(=O)Nc1ccc(OC)cc1
- Molecular Weight1
- 265.35
- CAS
- 92727-15-6
- 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).
- 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° | -71.33 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -451.42 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.33 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.92 | kJ/mol | Joback Calculated Property |
| log10WS | -4.37 | Crippen Calculated Property | |
| logPoct/wat | 4.214 | Crippen Calculated Property | |
| McVol | 221.740 | ml/mol | McGowan Calculated Property |
| Pc | 1890.36 | kPa | Joback Calculated Property |
| Tboil | 723.14 | K | Joback Calculated Property |
| Tc | 921.22 | K | Joback Calculated Property |
| Tfus | 444.80 | K | Joback Calculated Property |
| Vc | 0.845 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [630.94; 711.40] | J/mol×K | [723.14; 921.22] | 
|
| Cp,gas | 630.94 | J/mol×K | 723.14 | Joback Calculated Property |
| Cp,gas | 646.65 | J/mol×K | 756.15 | Joback Calculated Property |
| Cp,gas | 661.41 | J/mol×K | 789.17 | Joback Calculated Property |
| Cp,gas | 675.26 | J/mol×K | 822.18 | Joback Calculated Property |
| Cp,gas | 688.20 | J/mol×K | 855.19 | Joback Calculated Property |
| Cp,gas | 700.24 | J/mol×K | 888.21 | Joback Calculated Property |
| Cp,gas | 711.40 | J/mol×K | 921.22 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to P-methoxy carbanilic acid, n-heptyl ester.
Sources
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