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2-Chloro-5-fluoropyridine-6-carboxylic acid

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Name

2-Chloro-5-fluoropyridine-6-carboxylic acid

EINECS N/A
CAS No. 884494-76-2 Density 1.576 g/cm3
PSA 50.19000 LogP 1.57230
Solubility N/A Melting Point N/A
Formula C6H3ClFNO2 Boiling Point 296.4 °C at 760 mmHg
Molecular Weight 175.547 Flash Point 133.1 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 884494-76-2 (6-Chloro-3-fluoro-pyridine-2-carboxylic acid) Hazard Symbols N/A
Synonyms

6-chloro-3-fluoropyridine-2-carboxylic acid

 

2-Chloro-5-fluoropyridine-6-carboxylic acid Specification

This chemical is called 2-Chloro-5-fluoropyridine-6-carboxylic acid, and its systematic name is 2-pyridinecarboxylic acid, 6-chloro-3-fluoro-. With the molecular formula of C6H3ClFNO2, its molecular weight is 175.54. The CAS registry number of this chemical is 884494-76-2.

Other characteristics of the 2-Chloro-5-fluoropyridine-6-carboxylic acid can be summarised as followings: (1)ACD/LogP: 0.89; (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: 50.19 Å2; (11)Index of Refraction: 1.563; (12)Molar Refractivity: 36.16 cm3; (13)Molar Volume: 111.3 cm3; (14)Polarizability: 14.33×10-24cm3; (15)Surface Tension: 57.4 dyne/cm; (16)Density: 1.576 g/cm3; (17)Flash Point: 133.1 °C; (18)Enthalpy of Vaporization: 56.62 kJ/mol; (19)Boiling Point: 296.4 °C at 760 mmHg; (20)Vapour Pressure: 0.000649 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: c1cc(nc(c1F)C(=O)O)Cl
2.InChI: InChI=1/C6H3ClFNO2/c7-4-2-1-3(8)5(9-4)6(10)11/h1-2H,(H,10,11)
3.InChIKey: YGDRQLYJJGEHCC-UHFFFAOYAH

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