- InChI
- InChI=1S/C11H14N2/c1-8-5-10(7-12)6-9(2)11(8)13(3)4/h5-6H,1-4H3
- InChI Key
- GQYWEARFXOQOMB-UHFFFAOYSA-N
- Formula
- C11H14N2
- SMILES
- Cc1cc(C#N)cc(C)c1N(C)C
- Molecular Weight1
- 174.24
- CAS
- 13012-16-3
- ω : Acentric Factor.
- PAff : Proton affinity (kJ/mol).
- BasG : Gas basicity (kJ/mol).
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion 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).
- 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 | 0.5405 | Relay (1.0) Calculated Property | |
| PAff | 913.30 | kJ/mol | NIST |
| BasG | 886.80 | kJ/mol | NIST |
| ΔfG° | 369.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 170.41 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 21.65 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.11 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.93 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.45 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.241 | Crippen Calculated Property | |
| McVol | 153.450 | ml/mol | McGowan Calculated Property |
| Pc | 2462.92 | kPa | Joback Calculated Property |
| Tboil | 555.57 | K | Relay (1.0) Calculated Property |
| Tc | 782.02 | K | Relay (1.0) Calculated Property |
| Tfus | 350.15 | K | Relay (1.0) Calculated Property |
| Vc | 0.554 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [367.88; 435.95] | J/mol×K | [607.22; 826.14] | 
|
| Cp,gas | 367.88 | J/mol×K | 607.22 | Joback Calculated Property |
| Cp,gas | 381.06 | J/mol×K | 643.71 | Joback Calculated Property |
| Cp,gas | 393.47 | J/mol×K | 680.19 | Joback Calculated Property |
| Cp,gas | 405.13 | J/mol×K | 716.68 | Joback Calculated Property |
| Cp,gas | 416.08 | J/mol×K | 753.17 | Joback Calculated Property |
| Cp,gas | 426.34 | J/mol×K | 789.65 | Joback Calculated Property |
| Cp,gas | 435.95 | J/mol×K | 826.14 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to N,N,2,6-Tetramethyl-4-cyanoaniline.
Sources
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