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2,4-dichloro-5-(trifluoromethyl)pyrimidine

2,4-dichloro-5-(trifluoromethyl)pyrimidine

CAS: 3932-97-6

Formula: C5HCl2F3N2

SMILES: FC(F)(F)C1=CN=C(Cl)N=C1Cl

IUPAC: 2,4-dichloro-5-(trifluoromethyl)pyrimidine

InChI: InChI=1S/C5HCl2F3N2/c6-3-2(5(8,9)10)1-11-4(7)12-3/h1H

Composition: C (27.68%), H (0.46%), Cl (32.68%), F (26.27%), N (12.91%)

Molar Mass: 216.97

Atom Count: 13

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 215.9468879
Formal Charge 0
FSP3 0.2
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey IDRUEHMBFUJKAK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 40.06
Topological Polar Surface Area 25.78
Polarizability 14.2
Ring Count 1
Rotatable Bond Count 1

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99.97% <7 Days 3932-97-6 $5.61-$878.90$5.61$10.29$17.77$43.95$175.78$878.90
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95% <6 Days 3932-97-6 $27.60-$387.55$27.60$86.25$387.55
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97% <14 Days 3932-97-6 $94.50-$555.66$94.50$555.66
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