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155265-57-9 | 3-Pyridinecarbonitrile, 2-bromo-6-methyl-
CAS No: 155265-57-9 Catalog No: AG001NRY MDL No:MFCD06254423
Product Description
Catalog Number:
AG001NRY
Chemical Name:
3-Pyridinecarbonitrile, 2-bromo-6-methyl-
CAS Number:
155265-57-9
Molecular Formula:
C7H5BrN2
Molecular Weight:
197.0320
MDL Number:
MFCD06254423
IUPAC Name:
2-bromo-6-methylpyridine-3-carbonitrile
InChI:
InChI=1S/C7H5BrN2/c1-5-2-3-6(4-9)7(8)10-5/h2-3H,1H3
InChI Key:
XPTNCEKLFCYPKH-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(n1)Br)C#N
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.964g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.035g/mol
Monoisotopic Mass:
195.964g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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