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3810-11-5

Basic Information
CAS No.: 3810-11-5
Name: (3-AMINO-4-PYRIDINYL)PHENYLMETHANONE
Article Data: 11
Molecular Structure:
Molecular Structure of 3810-11-5 ((3-AMINO-4-PYRIDINYL)PHENYLMETHANONE)
Formula: C12H10N2O
Molecular Weight: 198.224
Synonyms: Ketone,3-amino-4-pyridyl phenyl (7CI,8CI);3-Amino-4-benzoylpyridine;(3-Aminopyridin-4-yl)(phenyl)methanone;
Density: 1.215 g/cm3
Melting Point: 126-128 °C
Boiling Point: 423.7 °C at 760 mmHg
Flash Point: 210.1 °C
PSA: 55.98000
LogP: 2.47600
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Specification

The CAS registry number of Methanone,(3-amino-4-pyridinyl)phenyl- is 3810-11-5. The systematic name is (3-aminopyridin-4-yl)(phenyl)methanone. In addition, the molecular formula is C12H10N2O and the molecular weight is 198.22. It should be stored in a cool and dry place.

Physical properties about Methanone,(3-amino-4-pyridinyl)phenyl- are: (1)ACD/LogP: 1.74 ; (2)#H bond acceptors: 3; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 3; (5)Polar Surface Area: 33.2 Å2; (6)Index of Refraction: 1.634; (7)Molar Refractivity: 58.37 cm3; (8)Molar Volume: 163 cm3; (9)Polarizability: 23.14 ×10-24cm3; (10)Surface Tension: 56.4 dyne/cm; (11)Density: 1.215 g/cm3; (12)Flash Point: 210.1 °C; (13)Enthalpy of Vaporization: 67.81 kJ/mol; (14)Boiling Point: 423.7 °C at 760 mmHg; (15)Vapour Pressure: 2.19E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1ccncc1N)c2ccccc2
(2)InChI: InChI=1/C12H10N2O/c13-11-8-14-7-6-10(11)12(15)9-4-2-1-3-5-9/h1-8H,13H2
(3)InChIKey: WXEOPBYWJZTKGV-UHFFFAOYAI