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CAS No.: | 117068-71-0 |
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Name: | 2-BROMO-6-BENZYLOXYPYRIDINE |
Article Data: | 16 |
Molecular Structure: | |
Formula: | C12H10BrNO |
Molecular Weight: | 264.121 |
Synonyms: | 2-(Benzyloxy)-6-bromopyridine;2-Bromo-6-benzyloxypyridine; |
Density: | 1.438 g/cm3 |
Melting Point: | 13-15 °C |
Boiling Point: | 338.6 °C at 760 mmHg |
Flash Point: | 158.6 °C |
PSA: | 22.12000 |
LogP: | 3.42310 |
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The Pyridine, 2-bromo-6-(phenylmethoxy)-, with the CAS registry number 117068-71-0, is also known as 2-Bromo-6-benzyloxypyridine. It belongs to the product categories of Bromopyridines; Halopyridines. This chemical's molecular formula is C12H10BrNO and molecular weight is 264.12. What's more, its systematic name is 2-(Benzyloxy)-6-bromopyridine. In addition, it must be stored at refrigerator.
Physical properties about Pyridine, 2-bromo-6-(phenylmethoxy)- are: (1)ACD/LogP: 3.90; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 22.12 Å2; (7)Index of Refraction: 1.604; (8)Molar Refractivity: 63.2 cm3; (9)Molar Volume: 183.5 cm3; (10)Polarizability: 25.05×10-24 cm3; (11)Surface Tension: 47 dyne/cm; (12)Density: 1.438 g/cm3; (13)Flash Point: 158.6 °C; (14)Enthalpy of Vaporization: 55.89 kJ/mol; (15)Boiling Point: 338.6 °C at 760 mmHg; (16)Vapour Pressure: 0.000191 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: Brc2nc(OCc1ccccc1)ccc2
(2) InChI: InChI=1/C12H10BrNO/c13-11-7-4-8-12(14-11)15-9-10-5-2-1-3-6-10/h1-8H,9H2
(3) InChIKey: WEMPEMXDSUATEK-UHFFFAOYAV