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8-chloro-2-(pyridin-3-yl)quinoline-4-carboxylic acid

8-chloro-2-(pyridin-3-yl)quinoline-4-carboxylic acid

CAS: 667436-24-0

Formula: C15H9ClN2O2

SMILES: OC(=O)C1=C2C=CC=C(Cl)C2=NC(=C1)C1=CC=CN=C1

IUPAC: 8-chloro-2-(pyridin-3-yl)quinoline-4-carboxylic acid

InChI: InChI=1S/C15H9ClN2O2/c16-12-5-1-4-10-11(15(19)20)7-13(18-14(10)12)9-3-2-6-17-8-9/h1-8H,(H,19,20)

Composition: C (63.28%), H (3.19%), Cl (12.45%), N (9.84%), O (11.24%)

Molar Mass: 284.7

Atom Count: 29

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 284.0352552
Formal Charge 0
FSP3 0
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey GWQRSIFXNZFRGO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 74.65
Topological Polar Surface Area 63.08
Polarizability 31.22
Ring Count 3
Rotatable Bond Count 2

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