- InChI
- InChI=1S/C26H45NO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-31-26(29)24(22(2)3)27-25(28)23-19-18-21-30-23/h18-19,21-22,24H,4-17,20H2,1-3H3,(H,27,28)
- InChI Key
- FTUZZILLZAHDTO-UHFFFAOYSA-N
- Formula
- C26H45NO4
- SMILES
-
CCCCCCCCCCCCCCCCOC(=O)C(NC(=O)
c1ccco1)C(C)C - Molecular Weight1
- 435.64
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation 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 | 1.1812 | Relay (1.0) Calculated Property | |
| ΔfG° | -171.34 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -950.90 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 125.11 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.03 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.06 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.059 | Crippen Calculated Property | |
| McVol | 382.600 | ml/mol | McGowan Calculated Property |
| Pc | 712.18 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [3119.00; 3119.00] |
|
|
| Inp | 3119.00 | NIST | |
| Inp | 3119.00 | NIST | |
| Tboil | 667.85 | K | Relay (1.0) Calculated Property |
| Tc | 894.47 | K | Relay (1.0) Calculated Property |
| Tfus | 370.22 | K | Relay (1.0) Calculated Property |
| Vc | 1.434 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to L-Valine, N-(2-furoyl)-, hexadecyl ester.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- McGowan Method
- NIST Webbook
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