5,6-difluoropyridine-3-carboxylic acid

5,6-difluoropyridine-3-carboxylic acid

CAS: 851386-33-9

Formula: C6H3F2NO2

SMILES: OC(=O)C1=CN=C(F)C(F)=C1

IUPAC: 5,6-difluoropyridine-3-carboxylic acid

InChI: InChI=1S/C6H3F2NO2/c7-4-1-3(6(10)11)2-9-5(4)8/h1-2H,(H,10,11)

Composition: C (45.30%), H (1.90%), F (23.88%), N (8.80%), O (20.11%)

Molar Mass: 159.092

Atom Count: 14

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	159.013184667
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	DGNBUWVYFMVMHG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	32.6
Topological Polar Surface Area	50.19
Polarizability	11.5
Ring Count	1
Rotatable Bond Count	1

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