- InChI
- InChI=1S/C17H20N2/c1-14-9-11-16(12-10-14)17(19(2)3)18-13-15-7-5-4-6-8-15/h4-12H,13H2,1-3H3/b18-17+
- InChI Key
- KUCTUQLDZPCQOW-ISLYRVAYSA-N
- Formula
- C17H20N2
- SMILES
- Cc1ccc(C(=NCc2ccccc2)N(C)C)cc1
- Molecular Weight1
- 252.35
- 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 | 0.6253 | Relay (1.0) Calculated Property | |
| ΔfG° | 416.40 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | 225.51 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 84.90 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.76 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.85 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.503 | Crippen Calculated Property | |
| McVol | 218.530 | ml/mol | McGowan Calculated Property |
| Pc | 1882.17 | kPa | Joback Calculated Property |
| Inp | 2023.00 | NIST | |
| Tboil | 635.20 | K | Relay (1.0) Calculated Property |
| Tc | 862.01 | K | Relay (1.0) Calculated Property |
| Tfus | 340.96 | K | Relay (1.0) Calculated Property |
| Vc | 0.798 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to N,N-Dimethyl-N'-benzyl-p-methylbenzamidine.
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
- Joback Method
- McGowan Method
- NIST Webbook
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