- InChI
- InChI=1S/C25H47NO4/c1-5-6-7-8-9-10-11-12-13-14-17-20-29-22(27)25(18-15-16-19-25)26-23(28)30-21-24(2,3)4/h5-21H2,1-4H3,(H,26,28)
- InChI Key
- NFQSKHZZJRJBAG-UHFFFAOYSA-N
- Formula
- C25H47NO4
- SMILES
-
CCCCCCCCCCCCCOC(=O)C1(N=C(O)OC
C(C)(C)C)CCCC1 - Molecular Weight1
- 425.64
- ΔfH°gas : Enthalpy of formation 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).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -949.18 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 100.69 | kJ/mol | Joback Calculated Property |
| log10WS | -7.48 | Crippen Calculated Property | |
| logPoct/wat | 7.130 | Crippen Calculated Property | |
| McVol | 377.110 | ml/mol | McGowan Calculated Property |
| Pc | 889.47 | kPa | Joback Calculated Property |
| Inp | 2845.00 | NIST | |
| Tboil | 1051.14 | K | Joback Calculated Property |
| Tc | 1291.40 | K | Joback Calculated Property |
Similar Compounds
Sources
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