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6-(3-fluorophenyl)pyridine-2-carboxylic acid

6-(3-fluorophenyl)pyridine-2-carboxylic acid

CAS: 887982-40-3

Formula: C12H8FNO2

SMILES: OC(=O)C1=CC=CC(=N1)C1=CC=CC(F)=C1

IUPAC: 6-(3-fluorophenyl)pyridine-2-carboxylic acid

InChI: InChI=1S/C12H8FNO2/c13-9-4-1-3-8(7-9)10-5-2-6-11(14-10)12(15)16/h1-7H,(H,15,16)

Composition: C (66.36%), H (3.71%), F (8.75%), N (6.45%), O (14.73%)

Molar Mass: 217.199

Atom Count: 24

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 217.053906665
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey LNVROFCFAZOMJU-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 55.77
Topological Polar Surface Area 50.19
Polarizability 22.36
Ring Count 2
Rotatable Bond Count 2

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Purity (%)
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Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 887982-40-3 $51.35-$143.12$51.35$63.37$86.31$143.12
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