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CAS No.: | 870063-62-0 |
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Name: | (3-FLUOROPYRIDIN-4-YL)METHANAMINE |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C6H7FN2 |
Molecular Weight: | 126.133 |
Synonyms: | [(3-Fluoropyridin-4-yl)methyl]amine; |
Density: | 1.18 g/cm3 |
Boiling Point: | 200.096 °C at 760 mmHg |
Flash Point: | 74.815 °C |
PSA: | 38.91000 |
LogP: | 1.37970 |
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The 4-Pyridinemethanamine,3-fluoro-, with CAS registry number 870063-62-0, belongs to the following product categories: (1)Building Blocks; (2)Pyridine. It has the systematic name of (3-fluoro-4-pyridyl)methanamine. Besides this, it is also called 4-Aminomethyl-3-fluoropyridine dihydrochloride. And the chemical formula of this chemical is C6H7FN2.
Physical properties of 4-Pyridinemethanamine,3-fluoro-: (1)ACD/LogP: 0.02; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 14.644; (7)#H bond acceptors: 2; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 38.91 Å2; (11)Index of Refraction: 1.526; (12)Molar Refractivity: 32.79 cm3; (13)Molar Volume: 106.855 cm3; (14)Polarizability: 12.999×10-24cm3; (15)Surface Tension: 43.482 dyne/cm; (16)Density: 1.18 g/cm3; (17)Flash Point: 74.815 °C; (18)Enthalpy of Vaporization: 43.63 kJ/mol; (19)Boiling Point: 200.096 °C at 760 mmHg; (20)Vapour Pressure: 0.33 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: c1cncc(c1CN)F
(2)InChI: InChI=1/C6H7FN2/c7-6-4-9-2-1-5(6)3-8/h1-2,4H,3,8H2
(3)InChIKey: YPJQSIDUEOBFTE-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C6H7FN2/c7-6-4-9-2-1-5(6)3-8/h1-2,4H,3,8H2
(5)Std. InChIKey: YPJQSIDUEOBFTE-UHFFFAOYSA-N