- InChI
- InChI=1S/C25H49NO4/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-20-29-24(27)23(19-6-2)26-25(28)30-21-22(3)4/h22-23H,5-21H2,1-4H3,(H,26,28)
- InChI Key
- OZBXKVYDPLLJOO-UHFFFAOYSA-N
- Formula
- C25H49NO4
- SMILES
-
CCCCCCCCCCCCCCCOC(=O)C(CCC)NC(
=O)OCC(C)C - Molecular Weight1
- 427.66
- 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° | -223.71 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1006.02 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 64.13 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 95.22 | kJ/mol | Joback Calculated Property |
| log10WS | -8.05 | Crippen Calculated Property | |
| logPoct/wat | 7.172 | Crippen Calculated Property | |
| McVol | 387.970 | ml/mol | McGowan Calculated Property |
| Pc | 817.73 | kPa | Joback Calculated Property |
| Inp | 2518.00 | NIST | |
| Tboil | 973.27 | K | Joback Calculated Property |
| Tc | 1198.16 | K | Joback Calculated Property |
| Tfus | 538.49 | K | Joback Calculated Property |
| Vc | 1.506 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1347.62; 1442.86] | J/mol×K | [973.27; 1198.16] | 
|
| Cp,gas | 1347.62 | J/mol×K | 973.27 | Joback Calculated Property |
| Cp,gas | 1367.68 | J/mol×K | 1010.75 | Joback Calculated Property |
| Cp,gas | 1386.00 | J/mol×K | 1048.23 | Joback Calculated Property |
| Cp,gas | 1402.62 | J/mol×K | 1085.72 | Joback Calculated Property |
| Cp,gas | 1417.61 | J/mol×K | 1123.20 | Joback Calculated Property |
| Cp,gas | 1431.00 | J/mol×K | 1160.68 | Joback Calculated Property |
| Cp,gas | 1442.86 | J/mol×K | 1198.16 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to l-Norvaline, N-isobutoxycarbonyl-, pentadecyl ester.
Sources
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