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2-Fluoropyridine-6-carboxylic acid

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Name

2-Fluoropyridine-6-carboxylic acid

EINECS N/A
CAS No. 402-69-7 Density 1.419 g/cm3
PSA 50.19000 LogP 0.91890
Solubility N/A Melting Point 139-143 °C(lit.)
Formula C6H4FNO2 Boiling Point 306.3 °C at 760 mmHg
Molecular Weight 141.102 Flash Point 139 °C
Transport Information N/A Appearance White powder
Safety 26-36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 402-69-7 (2-Fluoropyridine-6-carboxylic acid) Hazard Symbols IrritantXi
Synonyms

Picolinicacid, 6-fluoro- (8CI);2-Fluoro-6-pyridinecarboxylic acid;6-Fluoropicolinicacid;6-Fluoropyridine-2-carboxylic acid;NSC 16023;

Article Data 6

2-Fluoropyridine-6-carboxylic acid Specification

The 2-Fluoropyridine-6-carboxylic acid is an organic compound with the formula C6H4FNO2. The systematic name of this chemical is 6-fluoropyridine-2-carboxylic acid. With the CAS registry number 402-69-7, it is also named as 2-Pyridinecarboxylic acid, 6-fluoro-. The product's categories are Pharmacetical; Pyridine Series; Carboxylic Acids; Pyridines; Pyridine; Carboxylic Acids; Boronic Acid; Picolinic Acid Series.

The other characteristics of this product can be summarized as: (1)ACD/LogP: 0.23; (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): 1; (7)#H bond acceptors: 3; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 39.19 Å2; (11)Index of Refraction: 1.541; (12)Molar Refractivity: 31.26 cm3; (13)Molar Volume: 99.3 cm3; (14)Polarizability: 12.39×10-24 cm3; (15)Surface Tension: 54.9 dyne/cm; (16)Density: 1.419 g/cm3; (17)Flash Point: 139 °C ; (18)Enthalpy of Vaporization: 57.74 kJ/mol; (19)Boiling Point: 306.3 °C at 760 mmHg; (20)Vapour Pressure: 0.000339 mmHg at 25°C.

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. If you want to contact this product, you must wear suitable protective clothing.

People can use the following data to convert to the molecule structure. 
1. SMILES:c1cc(nc(c1)F)C(=O)O
2. InChI:InChI=1/C6H4FNO2/c7-5-3-1-2-4(8-5)6(9)10/h1-3H,(H,9,10) 
3. InChIKey:DIEMCUFYSOEIDU-UHFFFAOYAM
4. Std. InChI:InChI=1S/C6H4FNO2/c7-5-3-1-2-4(8-5)6(9)10/h1-3H,(H,9,10)
5. Std. InChIKey:DIEMCUFYSOEIDU-UHFFFAOYSA-N

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