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CAS No.: | 159429-52-4 |
---|---|
Name: | PHENYL-(2-PYRIDIN-3-YL-PHENYL)-METHANONE |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C18H13NO |
Molecular Weight: | 259.307 |
Synonyms: | 2-(3-Pyridinyl)benzophenone; |
Density: | 1.147 g/cm3 |
Melting Point: | 106-106.5 °C |
Boiling Point: | 467.365 °C at 760 mmHg |
Flash Point: | 239.934 °C |
PSA: | 29.96000 |
LogP: | 3.97960 |
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The Methanone,phenyl[2-(3-pyridinyl)phenyl]- is an organic compound with the formula C18H13NO. The systematic name of this chemical is Phenyl[2-(pyridin-3-yl)phenyl]methanone. With the CAS registry number 159429-52-4, it is also named as Phenyl-(2-pyridin-3-yl-phenyl)-methanone. Besides, its molecular weight is 259.3.
Physical properties about Methanone,phenyl[2-(3-pyridinyl)phenyl]- are: (1)ACD/LogP: 3.49; (2)ACD/LogD (pH 5.5): 4; (3)ACD/LogD (pH 7.4): 4; (4)ACD/BCF (pH 5.5): 309; (5)ACD/BCF (pH 7.4): 333; (6)ACD/KOC (pH 5.5): 2064; (7)ACD/KOC (pH 7.4): 2222; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 29.96 Å2; (11)Index of Refraction: 1.613; (12)Molar Refractivity: 78.729 cm3; (13)Molar Volume: 226.057 cm3; (14)Polarizability: 31.211×10-24 cm3; (15)Surface Tension: 47.807 dyne/cm; (16)Density: 1.147 g/cm3; (17)Flash Point: 239.934 °C; (18)Enthalpy of Vaporization: 72.933 kJ/mol; (19)Boiling Point: 467.365 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C18H13NO/c20-18(14-7-2-1-3-8-14)17-11-5-4-10-16(17)15-9-6-12-19-13-15/h1-13H
(2)InChIKey: PTJKKSZMSXBOSD-UHFFFAOYAG
(3)Std. InChI: InChI=1S/C18H13NO/c20-18(14-7-2-1-3-8-14)17-11-5-4-10-16(17)15-9-6-12-19-13-15/h1-13H
(4)Std. InChIKey: PTJKKSZMSXBOSD-UHFFFAOYSA-N