- InChI
- InChI=1S/C15H13N/c16-11-10-13-6-8-15(9-7-13)12-14-4-2-1-3-5-14/h1-9H,10,12H2
- InChI Key
- RNZDBGKQDKFAPR-UHFFFAOYSA-N
- Formula
- C15H13N
- SMILES
- N#CCc1ccc(Cc2ccccc2)cc1
- Molecular Weight1
- 207.27
- CAS
- 101096-72-4
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 423.79 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 273.54 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 23.81 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.68 | kJ/mol | Joback Calculated Property |
| log10WS | -4.24 | Crippen Calculated Property | |
| logPoct/wat | 3.343 | Crippen Calculated Property | |
| McVol | 176.070 | ml/mol | McGowan Calculated Property |
| Pc | 2412.37 | kPa | Joback Calculated Property |
| Tboil | 703.02 | K | Joback Calculated Property |
| Tc | 950.93 | K | Joback Calculated Property |
| Tfus | 389.16 | K | Joback Calculated Property |
| Vc | 0.685 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [449.70; 519.55] | J/mol×K | [703.02; 950.93] | 
|
| Cp,gas | 449.70 | J/mol×K | 703.02 | Joback Calculated Property |
| Cp,gas | 463.97 | J/mol×K | 744.34 | Joback Calculated Property |
| Cp,gas | 477.08 | J/mol×K | 785.66 | Joback Calculated Property |
| Cp,gas | 489.12 | J/mol×K | 826.97 | Joback Calculated Property |
| Cp,gas | 500.15 | J/mol×K | 868.29 | Joback Calculated Property |
| Cp,gas | 510.27 | J/mol×K | 909.61 | Joback Calculated Property |
| Cp,gas | 519.55 | J/mol×K | 950.93 | Joback Calculated Property |
Similar Compounds
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)
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