- InChI
- InChI=1S/C20H25N3O2/c1-2-3-4-5-9-16-25-20(24)21-17-12-14-19(15-13-17)23-22-18-10-7-6-8-11-18/h6-8,10-15H,2-5,9,16H2,1H3,(H,21,24)/b23-22+
- InChI Key
- GCLIEEGTFPJRCY-GHVJWSGMSA-N
- Formula
- C20H25N3O2
- SMILES
-
CCCCCCCOC(=O)Nc1ccc(N=Nc2ccccc
2)cc1 - Molecular Weight1
- 339.43
- CAS
- 94913-08-3
- 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).
- 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 | -138.65 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 87.59 | kJ/mol | Joback Calculated Property |
| log10WS | -6.29 | Crippen Calculated Property | |
| logPoct/wat | 6.621 | Crippen Calculated Property | |
| McVol | 278.220 | ml/mol | McGowan Calculated Property |
| Pc | 1377.86 | kPa | Joback Calculated Property |
| Tboil | 991.00 | K | Joback Calculated Property |
| Tc | 1229.23 | K | Joback Calculated Property |
Similar Compounds
Find more compounds similar to P-phenylazo carbanilic acid, n-heptyl ester.
Sources
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