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7-fluoro-5-hydroxy-2,3-dihydroinden-1-one

7-fluoro-5-hydroxy-2,3-dihydroinden-1-one

CAS: 1092347-76-6

Formula: C9H7FO2

SMILES: OC1=CC2=C(C(=O)CC2)C(F)=C1

IUPAC: 7-fluoro-5-hydroxy-2,3-dihydro-1H-inden-1-one

InChI: InChI=1S/C9H7FO2/c10-7-4-6(11)3-5-1-2-8(12)9(5)7/h3-4,11H,1-2H2

Composition: C (65.06%), H (4.25%), F (11.43%), O (19.26%)

Molar Mass: 166.151

Atom Count: 19

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 166.043007628
Formal Charge 0
FSP3 0.22
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey LUICGIHUMFRMFI-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 41.92
Topological Polar Surface Area 37.3
Polarizability 15.5
Ring Count 2
Rotatable Bond Count 0

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