- InChI
- InChI=1S/C23H31NO3/c1-2-3-4-5-6-7-10-18-27-22(25)16-17-24-23(26)21-15-11-13-19-12-8-9-14-20(19)21/h8-9,11-15H,2-7,10,16-18H2,1H3,(H,24,26)
- InChI Key
- VJWFUCNLQDHAMZ-UHFFFAOYSA-N
- Formula
- C23H31NO3
- SMILES
-
CCCCCCCCCOC(=O)CCNC(=O)c1cccc2
ccccc12 - Molecular Weight1
- 369.50
- 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° | 78.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -405.83 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 55.48 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 93.71 | kJ/mol | Joback Calculated Property |
| log10WS | -7.09 | Crippen Calculated Property | |
| logPoct/wat | 5.254 | Crippen Calculated Property | |
| McVol | 310.700 | ml/mol | McGowan Calculated Property |
| Pc | 1329.07 | kPa | Joback Calculated Property |
| Tboil | 956.61 | K | Joback Calculated Property |
| Tc | 1175.80 | K | Joback Calculated Property |
| Tfus | 595.36 | K | Joback Calculated Property |
| Vc | 1.202 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1009.24; 1085.65] | J/mol×K | [956.61; 1175.80] | 
|
| Cp,gas | 1009.24 | J/mol×K | 956.61 | Joback Calculated Property |
| Cp,gas | 1024.29 | J/mol×K | 993.14 | Joback Calculated Property |
| Cp,gas | 1038.31 | J/mol×K | 1029.67 | Joback Calculated Property |
| Cp,gas | 1051.37 | J/mol×K | 1066.21 | Joback Calculated Property |
| Cp,gas | 1063.56 | J/mol×K | 1102.74 | Joback Calculated Property |
| Cp,gas | 1074.96 | J/mol×K | 1139.27 | Joback Calculated Property |
| Cp,gas | 1085.65 | J/mol×K | 1175.80 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to «beta»-Alanine, N-(1-naphthoyl)-, nonyl ester.
Sources
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