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1257072-40-4 | 2-Pyrazinecarbonitrile, 3-chloro-6-(difluoromethyl)-
CAS No: 1257072-40-4 Catalog No: AG000OIQ MDL No:
Product Description
Catalog Number:
AG000OIQ
Chemical Name:
2-Pyrazinecarbonitrile, 3-chloro-6-(difluoromethyl)-
CAS Number:
1257072-40-4
Molecular Formula:
C6H2ClF2N3
Molecular Weight:
189.5500
IUPAC Name:
3-chloro-6-(difluoromethyl)pyrazine-2-carbonitrile
InChI:
InChI=1S/C6H2ClF2N3/c7-5-3(1-10)12-4(2-11-5)6(8)9/h2,6H
InChI Key:
LNDSKVFEEYHYOW-UHFFFAOYSA-N
SMILES:
N#Cc1nc(cnc1Cl)C(F)F
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.991g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.55g/mol
Monoisotopic Mass:
188.991g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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