- InChI
- InChI=1S/C18H29NO2/c1-2-3-4-5-6-7-8-9-13-16-21-18(20)19-17-14-11-10-12-15-17/h10-12,14-15H,2-9,13,16H2,1H3,(H,19,20)
- InChI Key
- GWMSSZJEBQKCFD-UHFFFAOYSA-N
- Formula
- C18H29NO2
- SMILES
- CCCCCCCCCCCOC(=O)Nc1ccccc1
- Molecular Weight1
- 291.43
- CAS
- 110273-47-7
- 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° | 68.56 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -369.65 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 44.30 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.53 | kJ/mol | Joback Calculated Property |
| log10WS | -5.93 | Crippen Calculated Property | |
| logPoct/wat | 5.766 | Crippen Calculated Property | |
| McVol | 258.140 | ml/mol | McGowan Calculated Property |
| Pc | 1530.66 | kPa | Joback Calculated Property |
| Tboil | 764.38 | K | Joback Calculated Property |
| Tc | 958.76 | K | Joback Calculated Property |
| Tfus | 443.86 | K | Joback Calculated Property |
| Vc | 0.995 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [771.67; 859.40] | J/mol×K | [764.38; 958.76] | 
|
| Cp,gas | 771.67 | J/mol×K | 764.38 | Joback Calculated Property |
| Cp,gas | 788.73 | J/mol×K | 796.78 | Joback Calculated Property |
| Cp,gas | 804.76 | J/mol×K | 829.17 | Joback Calculated Property |
| Cp,gas | 819.81 | J/mol×K | 861.57 | Joback Calculated Property |
| Cp,gas | 833.91 | J/mol×K | 893.96 | Joback Calculated Property |
| Cp,gas | 847.09 | J/mol×K | 926.36 | Joback Calculated Property |
| Cp,gas | 859.40 | J/mol×K | 958.76 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Carbanilic acid, n-undecyl ester.
Sources
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