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15862-31-4 | 2-Pyridinamine, 3-bromo-5-nitro-
CAS No: 15862-31-4 Catalog No: AG001QD9 MDL No:MFCD00955628
Product Description
Catalog Number:
AG001QD9
Chemical Name:
2-Pyridinamine, 3-bromo-5-nitro-
CAS Number:
15862-31-4
Molecular Formula:
C5H4BrN3O2
Molecular Weight:
218.0082
MDL Number:
MFCD00955628
IUPAC Name:
3-bromo-5-nitropyridin-2-amine
InChI:
InChI=1S/C5H4BrN3O2/c6-4-1-3(9(10)11)2-8-5(4)7/h1-2H,(H2,7,8)
InChI Key:
OFXNHXMPRZDIDM-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cnc(c(c1)Br)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:
216.949g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
218.01g/mol
Monoisotopic Mass:
216.949g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
84.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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