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1-(6-methylpyridin-3-yl)propan-1-one

1-(6-methylpyridin-3-yl)propan-1-one

CAS: 859055-95-1

Formula: C9H11NO

SMILES: CCC(=O)C1=CC=C(C)N=C1

IUPAC: 1-(6-methylpyridin-3-yl)propan-1-one

InChI: InChI=1S/C9H11NO/c1-3-9(11)8-5-4-7(2)10-6-8/h4-6H,3H2,1-2H3

Composition: C (72.46%), H (7.43%), N (9.39%), O (10.72%)

Molar Mass: 149.193

Atom Count: 22

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 149.084063978
Formal Charge 0
FSP3 0.33
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey ZAVQODDHDDZRJK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 43.52
Topological Polar Surface Area 29.96
Polarizability 16.77
Ring Count 1
Rotatable Bond Count 2

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