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CAS No.: | 206357-52-0 |
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Name: | (5-BROMO-PYRIDIN-2-YL)-PHENYL-METHANONE |
Article Data: | 9 |
Molecular Structure: | |
Formula: | C12H8BrNO |
Molecular Weight: | 262.106 |
Synonyms: | (5-Bromopyridin-2-yl)-phenylmethanone; |
Density: | 1.481 g/cm3 |
Boiling Point: | 356.9 °C at 760 mmHg |
Flash Point: | 169.7 °C |
PSA: | 29.96000 |
LogP: | 3.07510 |
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The CAS registry number of Methanone,(5-bromo-2-pyridinyl)phenyl- is 206357-52-0. The IUPAC name is (5-bromopyridin-2-yl)-phenylmethanone. In addition, the molecular formula is C12H8BrNO and the molecular weight is 262.10. It should be stored in a cool and dry place.
Physical properties about Methanone,(5-bromo-2-pyridinyl)phenyl- are: (1)ACD/LogP: 3.07; (2)ACD/LogD (pH 5.5): 3.07; (3)ACD/LogD (pH 7.4): 3.07; (4)ACD/BCF (pH 5.5): 127.22; (5)ACD/BCF (pH 7.4): 127.22; (6)ACD/KOC (pH 5.5): 1116.99; (7)ACD/KOC (pH 7.4): 1116.99; (8)#H bond acceptors: 2 ; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 29.96 Å2; (11)Index of Refraction: 1.615; (12)Molar Refractivity: 61.82 cm3; (13)Molar Volume: 176.9 cm3; (14)Polarizability: 24.51 ×10-24cm3; (15)Surface Tension: 50.4 dyne/cm; (16)Density: 1.481 g/cm3; (17)Flash Point: 169.7 °C; (18)Enthalpy of Vaporization: 60.23 kJ/mol; (19)Boiling Point: 356.9 °C at 760 mmHg; (20)Vapour Pressure: 2.82E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Brc1cnc(cc1)C(=O)c2ccccc2
(2)InChI: InChI=1/C12H8BrNO/c13-10-6-7-11(14-8-10)12(15)9-4-2-1-3-5-9/h1-8H
(3)InChIKey: LTXZWEQLVKTQRI-UHFFFAOYAH