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2,6-dichloro-5-fluoro-4-methylpyridine-3-carboxylic acid

2,6-dichloro-5-fluoro-4-methylpyridine-3-carboxylic acid

CAS: 132195-42-7

Formula: C7H4Cl2FNO2

SMILES: CC1=C(F)C(Cl)=NC(Cl)=C1C(O)=O

IUPAC: 2,6-dichloro-5-fluoro-4-methylpyridine-3-carboxylic acid

InChI: InChI=1S/C7H4Cl2FNO2/c1-2-3(7(12)13)5(8)11-6(9)4(2)10/h1H3,(H,12,13)

Composition: C (37.53%), H (1.80%), Cl (31.65%), F (8.48%), N (6.25%), O (14.28%)

Molar Mass: 224.01

Atom Count: 17

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 222.9603119
Formal Charge 0
FSP3 0.14
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey CACZOIOUVVFGLV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 48.15
Topological Polar Surface Area 50.19
Polarizability 17.48
Ring Count 1
Rotatable Bond Count 1

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