- InChI
- InChI=1S/C24H39NO4/c1-5-6-7-8-9-10-14-17-28-23(26)22(18-20(2)3)25(4)24(27)29-19-21-15-12-11-13-16-21/h11-13,15-16,20,22H,5-10,14,17-19H2,1-4H3
- InChI Key
- CYLPPLIOBHQTOQ-UHFFFAOYSA-N
- Formula
- C24H39NO4
- SMILES
-
CCCCCCCCCOC(=O)C(CC(C)C)N(C)C(
=O)OCc1ccccc1 - Molecular Weight1
- 405.57
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 1.0308 | Relay (1.0) Calculated Property | |
| ΔfG° | -98.33 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -848.18 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 53.51 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 114.33 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.62 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.55 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.963 | Crippen Calculated Property | |
| McVol | 350.120 | ml/mol | McGowan Calculated Property |
| Pc | 1050.73 | kPa | Joback Calculated Property |
| Inp | 2673.00 | NIST | |
| Tboil | 657.31 | K | Relay (1.0) Calculated Property |
| Tc | 869.52 | K | Relay (1.0) Calculated Property |
| Tfus | 279.95 | K | Relay (1.0) Calculated Property |
| Vc | 1.280 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1164.45; 1247.58] | J/mol×K | [939.34; 1150.73] | 
|
| Cp,gas | 1164.45 | J/mol×K | 939.34 | Joback Calculated Property |
| Cp,gas | 1181.61 | J/mol×K | 974.57 | Joback Calculated Property |
| Cp,gas | 1197.38 | J/mol×K | 1009.80 | Joback Calculated Property |
| Cp,gas | 1211.81 | J/mol×K | 1045.03 | Joback Calculated Property |
| Cp,gas | 1224.95 | J/mol×K | 1080.27 | Joback Calculated Property |
| Cp,gas | 1236.85 | J/mol×K | 1115.50 | Joback Calculated Property |
| Cp,gas | 1247.58 | J/mol×K | 1150.73 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to l-Leucine, N-benzyloxycarbonyl-N-methyl-, nonyl ester.
Sources
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