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5-methoxy-N-phenyl-2-(trifluoromethyl)pyrimidin-4-amine

5-methoxy-N-phenyl-2-(trifluoromethyl)pyrimidin-4-amine

CAS: 2374758-29-7

Formula: C12H10F3N3O

SMILES: COC1=C(NC2=CC=CC=C2)N=C(N=C1)C(F)(F)F

IUPAC: 5-methoxy-N-phenyl-2-(trifluoromethyl)pyrimidin-4-amine

InChI: InChI=1S/C12H10F3N3O/c1-19-9-7-16-11(12(13,14)15)18-10(9)17-8-5-3-2-4-6-8/h2-7H,1H3,(H,16,17,18)

Composition: C (53.54%), H (3.74%), F (21.17%), N (15.61%), O (5.94%)

Molar Mass: 269.227

Atom Count: 29

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 269.077596443
Formal Charge 0
FSP3 0.17
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey FBVJUIVSINYETB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 63.62
Topological Polar Surface Area 47.04
Polarizability 22.98
Ring Count 2
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 2374758-29-7 $51.35-$539.70$51.35$63.37$86.31$113.62$180.26$539.70
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