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1-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]methanamine

1-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]methanamine

CAS: 1196145-27-3

Formula: C7H8F3N3

SMILES: CC1=CC(=NC(CN)=N1)C(F)(F)F

IUPAC: 1-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]methanamine

InChI: InChI=1S/C7H8F3N3/c1-4-2-5(7(8,9)10)13-6(3-11)12-4/h2H,3,11H2,1H3

Composition: C (43.98%), H (4.22%), F (29.82%), N (21.98%)

Molar Mass: 191.157

Atom Count: 21

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 191.067031759
Formal Charge 0
FSP3 0.43
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey XUTNJYLLZGPDTJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 40.9
Topological Polar Surface Area 51.8
Polarizability 14.95
Ring Count 1
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 1196145-27-3 $51.35-$2,052.81$51.35$63.37$86.31$654.41$2,052.81
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