- InChI
- InChI=1S/C27H51NO4/c1-8-9-10-11-12-13-14-17-31-26(29)24(18-20(2)3)28(7)27(30)32-25-19-22(6)15-16-23(25)21(4)5/h20-25H,8-19H2,1-7H3
- InChI Key
- CWBDQVQQTFHMFV-UHFFFAOYSA-N
- Formula
- C27H51NO4
- SMILES
-
CCCCCCCCCOC(=O)C(CC(C)C)N(C)C(
=O)OC1CC(C)CCC1C(C)C - Molecular Weight1
- 453.70
- 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 | 1.0159 | Relay (1.0) Calculated Property | |
| ΔfG° | -178.89 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1139.60 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 57.69 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 119.65 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.74 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.52 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.224 | Crippen Calculated Property | |
| McVol | 405.290 | ml/mol | McGowan Calculated Property |
| Pc | 790.37 | kPa | Joback Calculated Property |
| Inp | [2760.00; 2760.00] |
|
|
| Inp | 2760.00 | NIST | |
| Inp | 2760.00 | NIST | |
| Tboil | 667.92 | K | Relay (1.0) Calculated Property |
| Tc | 870.40 | K | Relay (1.0) Calculated Property |
| Tfus | 277.36 | K | Relay (1.0) Calculated Property |
| Vc | 1.464 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1460.33; 1551.16] | J/mol×K | [991.07; 1214.56] |
|
| Cp,gas | 1460.33 | J/mol×K | 991.07 | Joback Calculated Property |
| Cp,gas | 1480.49 | J/mol×K | 1028.32 | Joback Calculated Property |
| Cp,gas | 1498.57 | J/mol×K | 1065.57 | Joback Calculated Property |
| Cp,gas | 1514.62 | J/mol×K | 1102.82 | Joback Calculated Property |
| Cp,gas | 1528.70 | J/mol×K | 1140.07 | Joback Calculated Property |
| Cp,gas | 1540.86 | J/mol×K | 1177.31 | Joback Calculated Property |
| Cp,gas | 1551.16 | J/mol×K | 1214.56 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to L-Leucine, N-methyl-N-((1R)-(-)-menthyloxycarbonyl)-, nonyl ester.
Sources
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