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| CAS No.: | 4282-46-6 |
|---|---|
| Name: | 3-(4-Nitrophenyl)pyridine |
| Article Data: | 31 |
| Molecular Structure: | |
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| Formula: | C11H8N2O2 |
| Molecular Weight: | 200.197 |
| Synonyms: | 3-(4-NITROPHENYL)PYRIDINE |
| Density: | 1.252g/cm3 |
| Boiling Point: | 364.6 °C at 760 mmHg |
| Flash Point: | 174.3 °C |
| PSA: | 58.71000 |
| LogP: | 3.18000 |
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- Total:24 Page 1 of 1 1
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Specification
The 3-(4-Nitrophenyl)pyridine, with CAS registry number 4282-46-6, belongs to the following product category: Pharmacetical. It has the systematic name of 3-(4-nitrophenyl)pyridine. Besides this, it is also called pyridine, 3-(4-nitrophenyl)-. And the chemical formula of this chemical is C11H8N2O2.
Physical properties of 3-(4-Nitrophenyl)pyridine: (1)ACD/LogP: 2.28; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 58.71 Å2; (7)Index of Refraction: 1.611; (8)Molar Refractivity: 55.48 cm3; (9)Molar Volume: 159.7 cm3; (10)Polarizability: 21.99×10-24cm3; (11)Surface Tension: 52.5 dyne/cm; (12)Density: 1.252 g/cm3; (13)Flash Point: 174.3 °C; (14)Enthalpy of Vaporization: 58.68 kJ/mol; (15)Boiling Point: 364.6 °C at 760 mmHg; (16)Vapour Pressure: 3.49E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: [O-][N+](=O)c2ccc(c1cccnc1)cc2
(2)InChI: InChI=1/C11H8N2O2/c14-13(15)11-5-3-9(4-6-11)10-2-1-7-12-8-10/h1-8H
(3)InChIKey: DKWZMBYPPLMXQO-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C11H8N2O2/c14-13(15)11-5-3-9(4-6-11)10-2-1-7-12-8-10/h1-8H
(5)Std. InChIKey: DKWZMBYPPLMXQO-UHFFFAOYSA-N