- InChI
- InChI=1S/C15H22N2O/c1-2-18-15-9-7-8-14(12-15)16-13-17-10-5-3-4-6-11-17/h7-9,12-13H,2-6,10-11H2,1H3/b16-13+
- InChI Key
- CGBLEGCHZRAXKR-DTQAZKPQSA-N
- Formula
- C15H22N2O
- SMILES
- CCOc1cccc(N=CN2CCCCCC2)c1
- Molecular Weight1
- 246.35
- 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 | 0.6213 | Relay (1.0) Calculated Property | |
| ΔfG° | 238.94 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -110.33 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 81.64 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.35 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.73 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.621 | Crippen Calculated Property | |
| McVol | 209.120 | ml/mol | McGowan Calculated Property |
| Pc | 1981.23 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 2199.00 | NIST | |
| Tboil | 650.36 | K | Relay (1.0) Calculated Property |
| Tc | 843.79 | K | Relay (1.0) Calculated Property |
| Tfus | 337.64 | K | Relay (1.0) Calculated Property |
| Vc | 0.740 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Formamidine, 3,3-hexamethyleno-1-(3-ethoxyphenyl).
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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