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CAS No.: | 134896-35-8 |
---|---|
Name: | 2-PHENYL-3-NITROPYRIDINE |
Article Data: | 20 |
Molecular Structure: | |
Formula: | C11H8N2O2 |
Molecular Weight: | 200.197 |
Synonyms: | 2-Phenyl-3-nitropyridine;3-Nitro-2-phenylpyridine; |
Density: | 1.252g/cm3 |
Boiling Point: | 328.5 °C at 760 mmHg |
Flash Point: | 152.4 °C |
Safety: | 24/25 |
PSA: | 58.71000 |
LogP: | 3.18000 |
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The Pyridine,3-nitro-2-phenyl-, with CAS registry number 134896-35-8, has the systematic name of 3-nitro-2-phenylpyridine. Besides this, it is also called 2-Phenyl-3-nitropyridine. And the chemical formula of this chemical is C11H8N2O2. When use this chemical, please avoid contact with skin and eyes.
Physical properties of Pyridine,3-nitro-2-phenyl-: (1)ACD/LogP: 2.29; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.29; (4)ACD/LogD (pH 7.4): 2.29; (5)ACD/BCF (pH 5.5): 32.17; (6)ACD/BCF (pH 7.4): 32.17; (7)ACD/KOC (pH 5.5): 417.47; (8)ACD/KOC (pH 7.4): 417.47; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 58.71 Å2; (13)Index of Refraction: 1.611; (14)Molar Refractivity: 55.48 cm3; (15)Molar Volume: 159.7 cm3; (16)Polarizability: 21.99×10-24cm3; (17)Surface Tension: 52.5 dyne/cm; (18)Density: 1.252 g/cm3; (19)Flash Point: 152.4 °C; (20)Enthalpy of Vaporization: 54.82 kJ/mol; (21)Boiling Point: 328.5 °C at 760 mmHg; (22)Vapour Pressure: 0.000362 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: [O-][N+](=O)c2cccnc2c1ccccc1
(2)InChI: InChI=1/C11H8N2O2/c14-13(15)10-7-4-8-12-11(10)9-5-2-1-3-6-9/h1-8H
(3)InChIKey: GEALTJGFPPNOJE-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C11H8N2O2/c14-13(15)10-7-4-8-12-11(10)9-5-2-1-3-6-9/h1-8H
(5)Std. InChIKey: GEALTJGFPPNOJE-UHFFFAOYSA-N