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122918-25-6 | 2-Pyridinecarbonitrile, 6-bromo-
CAS No: 122918-25-6 Catalog No: AG000JRN MDL No:MFCD00234142
Product Description
Catalog Number:
AG000JRN
Chemical Name:
2-Pyridinecarbonitrile, 6-bromo-
CAS Number:
122918-25-6
Molecular Formula:
C6H3BrN2
Molecular Weight:
183.0054
MDL Number:
MFCD00234142
IUPAC Name:
6-bromopyridine-2-carbonitrile
InChI:
InChI=1S/C6H3BrN2/c7-6-3-1-2-5(4-8)9-6/h1-3H
InChI Key:
HNEBPTAKURBYRM-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(n1)Br
Properties
Complexity:
137
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.948g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
183.008g/mol
Monoisotopic Mass:
181.948g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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