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1-[3-fluoro-4-(pyrazol-1-yl)phenyl]ethanone

1-[3-fluoro-4-(pyrazol-1-yl)phenyl]ethanone

CAS: 1152964-31-2

Formula: C11H9FN2O

SMILES: CC(=O)C1=CC(F)=C(C=C1)N1C=CC=N1

IUPAC: 1-[3-fluoro-4-(1H-pyrazol-1-yl)phenyl]ethan-1-one

InChI: InChI=1S/C11H9FN2O/c1-8(15)9-3-4-11(10(12)7-9)14-6-2-5-13-14/h2-7H,1H3

Composition: C (64.70%), H (4.44%), F (9.30%), N (13.72%), O (7.83%)

Molar Mass: 204.204

Atom Count: 24

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 204.069891081
Formal Charge 0
FSP3 0.09
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey GEYFXUVQFYDULL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 55.04
Topological Polar Surface Area 34.89
Polarizability 20.8
Ring Count 2
Rotatable Bond Count 2

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