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3-fluoroquinoline-8-carboxylic acid

3-fluoroquinoline-8-carboxylic acid

CAS: 1807542-81-9

Formula: C10H6FNO2

SMILES: OC(=O)C1=C2N=CC(F)=CC2=CC=C1

IUPAC: 3-fluoroquinoline-8-carboxylic acid

InChI: InChI=1S/C10H6FNO2/c11-7-4-6-2-1-3-8(10(13)14)9(6)12-5-7/h1-5H,(H,13,14)

Composition: C (62.83%), H (3.16%), F (9.94%), N (7.33%), O (16.74%)

Molar Mass: 191.161

Atom Count: 20

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 191.0382566
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey ZFLUVYREXQUUNH-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 47.45
Topological Polar Surface Area 50.19
Polarizability 18.94
Ring Count 2
Rotatable Bond Count 1

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