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1197229-15-4 | Pyrazine, 2-(chloromethyl)-3-(trifluoromethyl)-
CAS No: 1197229-15-4 Catalog No: AG000PJI MDL No:
Product Description
Catalog Number:
AG000PJI
Chemical Name:
Pyrazine, 2-(chloromethyl)-3-(trifluoromethyl)-
CAS Number:
1197229-15-4
Molecular Formula:
C6H4ClF3N2
Molecular Weight:
196.5576
IUPAC Name:
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
InChI Key:
FRTIQPPRWPBCTK-UHFFFAOYSA-N
SMILES:
ClCc1nccnc1C(F)(F)F
Properties
Complexity:
150
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.002g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.557g/mol
Monoisotopic Mass:
196.002g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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