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3-Pyridinecarboxaldehyde,2-fluoro- (36404-90-7)

Identification
Name:3-Pyridinecarboxaldehyde,2-fluoro-
Synonyms:2-Fluoropyridine-3-carboxaldehyde;
CAS:36404-90-7
Molecular Formula: C6H4FNO
Molecular Weight: 125.1
InChI: InChI=1/C7H3BrF3I/c8-4-1-2-6(12)5(3-4)7(9,10)11/h1-3H
Molecular Structure: (C6H4FNO) 2-Fluoropyridine-3-carboxaldehyde;
Properties
Flash Point: 73 ºC
Boiling Point: 50 ºCmm Hg
Density:1.250
Refractive index:1.520
Specification:

The IUPAC name of 2-Fluoro-3-formylpyridine is 2-fluoropyridine-3-carbaldehyde. With the CAS registry number 36404-90-7, it is also named as 3-Pyridinecarboxaldehyde, 2-fluoro-; 2,4,6-Trifluoroaniline. The product's categories is pyridine, pharmacetical, pyridine series, halogenated, organohalides and fluorinated heterocyclic series. The price of this product changes with the market.

The other characteristics of this product can be summarized as: (1)ACD/LogP: -0.18; (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): 19; (6)ACD/KOC (pH 7.4): 19; (7)#H bond acceptors: 2; (8)#H bond donors: 0; (9)#Freely Rotating Bonds: 1; (10)Index of Refraction: 1.544; (11)Molar Refractivity: 31.091 cm3; (12)Molar Volume: 98.533 cm3; (13)Polarizability: 12.325×10-24 cm3; (14)Surface Tension: 43.884 dyne/cm; (15)Enthalpy of Vaporization: 45.727 kJ/mol; (16)Vapour Pressure: 0.111 mmHg at 25°C; (17)Rotatable Bond Count: 1; (18)Exact Mass: 125.027692; (19)MonoIsotopic Mass: 125.027692; (20)Topological Polar Surface Area: 30; (21)Heavy Atom Count: 9.

When you are using this chemical, please be cautious about it as the following. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

People can use the following data to convert to the molecule structure.
1. SMILES: c1cc(c(nc1)F)C=O;
2. InChI: InChI=1/C6H4FNO/c7-6-5(4-9)2-1-3-8-6/h1-4H.

Flash Point: 73 ºC
Safety Data
Hazard Symbols Xn: Harmful