- InChI
- InChI=1S/C34H65NO4/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24-38-33(36)31(25-27(2)3)35(7)34(37)39-32-26-29(6)22-23-30(32)28(4)5/h27-32H,8-26H2,1-7H3
- InChI Key
- XIXMFKUFHODYOL-UHFFFAOYSA-N
- Formula
- C34H65NO4
- SMILES
-
CCCCCCCCCCCCCCCCOC(=O)C(CC(C)C
)N(C)C(=O)OC1CC(C)CCC1C(C)C - Molecular Weight1
- 551.88
- 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 | 1.2687 | Relay (1.0) Calculated Property | |
| ΔfG° | -119.95 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1280.26 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 75.82 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 147.91 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.00 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.66 | Relay (1.0) Calculated Property | |
| logPoct/wat | 9.955 | Crippen Calculated Property | |
| McVol | 503.920 | ml/mol | McGowan Calculated Property |
| Pc | 559.15 | kPa | Joback Calculated Property |
| Inp | [3463.00; 3463.00] |
|
|
| Inp | 3463.00 | NIST | |
| Inp | 3463.00 | NIST | |
| Tboil | 714.67 | K | Relay (1.0) Calculated Property |
| Tc | 922.40 | K | Relay (1.0) Calculated Property |
| Tfus | 292.02 | K | Relay (1.0) Calculated Property |
| Vc | 1.845 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1914.16; 1988.02] | J/mol×K | [1151.23; 1455.56] |
|
| Cp,gas | 1914.16 | J/mol×K | 1151.23 | Joback Calculated Property |
| Cp,gas | 1935.32 | J/mol×K | 1201.95 | Joback Calculated Property |
| Cp,gas | 1952.68 | J/mol×K | 1252.67 | Joback Calculated Property |
| Cp,gas | 1966.43 | J/mol×K | 1303.40 | Joback Calculated Property |
| Cp,gas | 1976.77 | J/mol×K | 1354.12 | Joback Calculated Property |
| Cp,gas | 1983.90 | J/mol×K | 1404.84 | Joback Calculated Property |
| Cp,gas | 1988.02 | J/mol×K | 1455.56 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to L-Leucine, N-methyl-N-((1R)-(-)-menthyloxycarbonyl)-, hexadecyl ester.
Sources
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