- InChI
- InChI=1S/C12H18N2/c1-4-12(14(2)3)13-10-11-8-6-5-7-9-11/h5-9H,4,10H2,1-3H3/b13-12+
- InChI Key
- GTOOPRWBIUWQHJ-OUKQBFOZSA-N
- Formula
- C12H18N2
- SMILES
- CCC(=NCc1ccccc1)N(C)C
- Molecular Weight1
- 190.28
- 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 | 0.5167 | Relay (1.0) Calculated Property | |
| ΔfG° | 313.64 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | 105.56 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 67.38 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.08 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.63 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.557 | Crippen Calculated Property | |
| McVol | 171.840 | ml/mol | McGowan Calculated Property |
| Pc | 2181.56 | kPa | Joback Calculated Property |
| Inp | 1617.00 | NIST | |
| Tboil | 556.30 | K | Relay (1.0) Calculated Property |
| Tc | 737.48 | K | Relay (1.0) Calculated Property |
| Tfus | 292.26 | K | Relay (1.0) Calculated Property |
| Vc | 0.627 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to N,N-Dimethyl-N'-benzyl-propionamidine.
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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