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CAS No.: | 403-45-2 |
---|---|
Name: | 6-Fluoronicotinic acid |
Article Data: | 9 |
Molecular Structure: | |
Formula: | C6H4FNO2 |
Molecular Weight: | 141.102 |
Synonyms: | 2-Fluoro-5-pyridinecarboxylic acid;6-Fluoropyridine-3-Formic Acid;2-Fluoro-5-pyridine carboxylic acid;3-Pyridinecarboxylic acid, 6-fluoro-;6-Fluoro-3-pyridinecarboxylicacid;6-fluoropyridine-3-carboxylic acid; |
Density: | 1.419 g/cm3 |
Melting Point: | 144-148 °C(lit.) |
Boiling Point: | 309.4 °C at 760 mmHg |
Flash Point: | 140.9 °C |
Appearance: | off-white crystal power |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26-36 |
PSA: | 50.19000 |
LogP: | 0.91890 |
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The 6-fluoronicotinic acid is an organic compound with the formula C6H4FNO2. The IUPAC name of this chemical is 6-fluoropyridine-3-carboxylic acid. With the CAS registry number 403-45-2, it is also named as Acide 6-fluoropyridine-3-carboxylique. The product's categories are Pyridine; Pyridine Series; Pyridines; Building Blocks; Carboxy; Boronic Acid; Picolinic Acid Series. Besides, it should be stored in a closed cool and dry place.
Physical properties about 6-fluoronicotinic acid are: (1)ACD/LogP: 0.38; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 3; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 39.19 Å2; (10)Index of Refraction: 1.541; (11)Molar Refractivity: 31.26 cm3; (12)Molar Volume: 99.3 cm3; (13)Polarizability: 12.39×10-24cm3; (14)Surface Tension: 54.9 dyne/cm; (15)Density: 1.419 g/cm3; (16)Flash Point: 140.9 °C; (17)Enthalpy of Vaporization: 58.09 kJ/mol; (18)Boiling Point: 309.4 °C at 760 mmHg; (19)Vapour Pressure: 0.000277 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(ncc1C(=O)O)F
(2)InChI: InChI=1/C6H4FNO2/c7-5-2-1-4(3-8-5)6(9)10/h1-3H,(H,9,10)
(3)InChIKey: UJDLCTNVHJEBDG-UHFFFAOYAP
(4)Std. InChI: InChI=1S/C6H4FNO2/c7-5-2-1-4(3-8-5)6(9)10/h1-3H,(H,9,10)
(5)Std. InChIKey: UJDLCTNVHJEBDG-UHFFFAOYSA-N