- InChI
- InChI=1S/C14H12N2/c15-11-14(16,12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10H,16H2
- InChI Key
- XLHAFLQPSYZDOK-UHFFFAOYSA-N
- Formula
- C14H12N2
- SMILES
- N#CC(N)(c1ccccc1)c1ccccc1
- Molecular Weight1
- 208.26
- CAS
- 52460-99-8
- ω : Acentric Factor.
- 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 | 0.5417 | Relay (... Calculated Property | |
| ΔfG° | 494.29 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 366.04 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 19.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 81.63 | kJ/mol | Relay (... Calculated Property |
| IE | 8.73 | eV | Relay (... Calculated Property |
| log10WS | -3.79 | Relay (... Calculated Property | |
| logPoct/wat | 2.412 | Crippen Calculated Property | |
| McVol | 171.960 | ml/mol | McGowan Calculated Property |
| Pc | 2925.00 | kPa | Joback Calculated Property |
| Tboil | 576.75 | K | Relay (... Calculated Property |
| Tc | 881.50 | K | Relay (... Calculated Property |
| Tfus | 346.88 | K | Relay (... Calculated Property |
| Vc | 0.599 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [459.24; 521.49] | J/mol×K | [744.46; 1017.09] | 
|
| Cp,gas | 459.24 | J/mol×K | 744.46 | Joback Calculated Property |
| Cp,gas | 472.32 | J/mol×K | 789.90 | Joback Calculated Property |
| Cp,gas | 484.11 | J/mol×K | 835.34 | Joback Calculated Property |
| Cp,gas | 494.76 | J/mol×K | 880.78 | Joback Calculated Property |
| Cp,gas | 504.43 | J/mol×K | 926.21 | Joback Calculated Property |
| Cp,gas | 513.29 | J/mol×K | 971.65 | Joback Calculated Property |
| Cp,gas | 521.49 | J/mol×K | 1017.09 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glycinonitrile, 2,2-diphenyl-.
Sources
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