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2-(chloromethyl)-3-(trifluoromethyl)pyrazine

2-(chloromethyl)-3-(trifluoromethyl)pyrazine

CAS: 1197229-15-4

Formula: C6H4ClF3N2

SMILES: FC(F)(F)C1=NC=CN=C1CCl

IUPAC: 2-(chloromethyl)-3-(trifluoromethyl)pyrazine

InChI: InChI=1S/C6H4ClF3N2/c7-3-4-5(6(8,9)10)12-2-1-11-4/h1-2H,3H2

Composition: C (36.66%), H (2.05%), Cl (18.04%), F (29.00%), N (14.25%)

Molar Mass: 196.56

Atom Count: 16

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 196.0015103
Formal Charge 0
FSP3 0.33
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey FRTIQPPRWPBCTK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 36.69
Topological Polar Surface Area 25.78
Polarizability 13.71
Ring Count 1
Rotatable Bond Count 2

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95% <5 Days 1197229-15-4 $2,600.00-$4,600.00$2,600.00$4,600.00
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