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7-fluoro-1H,2H,3H,4H,9H-pyrido[3,4-b]indole

7-fluoro-1H,2H,3H,4H,9H-pyrido[3,4-b]indole

CAS: 177858-80-9

Formula: C11H11FN2

SMILES: FC1=CC=C2C3=C(CNCC3)NC2=C1

IUPAC: 7-fluoro-1H,2H,3H,4H,9H-pyrido[3,4-b]indole

InChI: InChI=1S/C11H11FN2/c12-7-1-2-8-9-3-4-13-6-11(9)14-10(8)5-7/h1-2,5,13-14H,3-4,6H2

Composition: C (69.46%), H (5.83%), F (9.99%), N (14.73%)

Molar Mass: 190.221

Atom Count: 25

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 190.090626525
Formal Charge 0
FSP3 0.27
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 2
InChIKey OTGGOPSBNVEBDA-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 53.8
Topological Polar Surface Area 27.82
Polarizability 21.42
Ring Count 3
Rotatable Bond Count 0

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