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N-methyl-3-phenyl-6-(trifluoromethyl)-1,2,4-triazin-5-amine

N-methyl-3-phenyl-6-(trifluoromethyl)-1,2,4-triazin-5-amine

CAS: 383148-46-7

Formula: C11H9F3N4

SMILES: CNC1=NC(=NN=C1C(F)(F)F)C1=CC=CC=C1

IUPAC: N-methyl-3-phenyl-6-(trifluoromethyl)-1,2,4-triazin-5-amine

InChI: InChI=1S/C11H9F3N4/c1-15-10-8(11(12,13)14)17-18-9(16-10)7-5-3-2-4-6-7/h2-6H,1H3,(H,15,16,18)

Composition: C (51.97%), H (3.57%), F (22.42%), N (22.04%)

Molar Mass: 254.216

Atom Count: 27

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 254.077930795
Formal Charge 0
FSP3 0.18
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey VWCUKIMQFRFYEF-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 74.11
Topological Polar Surface Area 50.7
Polarizability 22.04
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 383148-46-7 $51.35-$524.40$51.35$63.37$86.31$524.40
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