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N-{3-[5-(trifluoromethyl)pyridin-2-yl]phenyl}prop-2-enamide

N-{3-[5-(trifluoromethyl)pyridin-2-yl]phenyl}prop-2-enamide

CAS: 2270918-47-1

Formula: C15H11F3N2O

SMILES: FC(F)(F)C1=CN=C(C=C1)C1=CC=CC(NC(=O)C=C)=C1

IUPAC: N-{3-[5-(trifluoromethyl)pyridin-2-yl]phenyl}prop-2-enamide

InChI: InChI=1S/C15H11F3N2O/c1-2-14(21)20-12-5-3-4-10(8-12)13-7-6-11(9-19-13)15(16,17)18/h2-9H,1H2,(H,20,21)

Composition: C (61.65%), H (3.79%), F (19.50%), N (9.59%), O (5.47%)

Molar Mass: 292.261

Atom Count: 32

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 292.082347471
Formal Charge 0
FSP3 0.07
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey QZOKCPVJPWSNKR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 74.15
Topological Polar Surface Area 41.99
Polarizability 27.82
Ring Count 2
Rotatable Bond Count 4

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95% <2 Days 2270918-47-1 $51.35-$86.31$51.35$63.37$86.31
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