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6945-67-1 | 2-Bromo-4-nitropyridine
CAS No: 6945-67-1 Catalog No: AG003GOW MDL No:MFCD03701383
Product Description
Catalog Number:
AG003GOW
Chemical Name:
2-Bromo-4-nitropyridine
CAS Number:
6945-67-1
Molecular Formula:
C5H3BrN2O2
Molecular Weight:
202.9935
MDL Number:
MFCD03701383
IUPAC Name:
2-bromo-4-nitropyridine
InChI:
InChI=1S/C5H3BrN2O2/c6-5-3-4(8(9)10)1-2-7-5/h1-3H
InChI Key:
AFVITJKRFRRQKT-UHFFFAOYSA-N
SMILES:
Brc1nccc(c1)[N+](=O)[O-]
NSC Number:
52199
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.938g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.995g/mol
Monoisotopic Mass:
201.938g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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