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| Name |
Benzonitrile,4-(1H-imidazol-2-yl)- |
EINECS | N/A |
| CAS No. | 98298-49-8 | Density | 1.27 g/cm3 |
| PSA | 52.47000 | LogP | 1.94838 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C10H7N3 | Boiling Point | 423.8 °C at 760 mmHg |
| Molecular Weight | 169.186 | Flash Point | 138.9 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
4-(1H-imidazol-2-yl)benzonitrile; |
Benzonitrile,4-(1H-imidazol-2-yl)- Specification
The Benzonitrile,4-(1H-imidazol-2-yl)- is an organic compound with the formula C10H7N3. With the CAS registry number 98298-49-8, its systematic name is 4-(1H-imidazol-2-yl)benzonitrile.
Physical properties of Benzonitrile,4-(1H-imidazol-2-yl)-: (1)ACD/LogP: 1.53; (2)#H bond acceptors: 3; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 1; (5)Index of Refraction: 1.638; (6)Molar Refractivity: 47.74 cm3; (7)Molar Volume: 132.8 cm3; (8)Surface Tension: 68.3 dyne/cm; (9)Density: 1.27 g/cm3; (10)Flash Point: 138.9 °C; (11)Enthalpy of Vaporization: 67.82 kJ/mol; (12)Boiling Point: 423.8 °C at 760 mmHg; (13)Vapour Pressure: 2.18E-07 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: N#Cc2ccc(c1nccn1)cc2
(2)InChI: InChI=1/C10H7N3/c11-7-8-1-3-9(4-2-8)10-12-5-6-13-10/h1-6H,(H,12,13)
(3)InChIKey: ISJCKCQDMBPKML-UHFFFAOYAY
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