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Home > Bromides > 1221793-62-9
1221793-62-9 | Pyridine, 3-bromo-5-chloro-, 1-oxide
CAS No: 1221793-62-9 Catalog No: AG0016W1 MDL No:MFCD16036154
Product Description
Catalog Number:
AG0016W1
Chemical Name:
Pyridine, 3-bromo-5-chloro-, 1-oxide
CAS Number:
1221793-62-9
Molecular Formula:
C5H3BrClNO
Molecular Weight:
208.4404
MDL Number:
MFCD16036154
IUPAC Name:
3-bromo-5-chloro-1-oxidopyridin-1-ium
InChI:
InChI=1S/C5H3BrClNO/c6-4-1-5(7)3-8(9)2-4/h1-3H
InChI Key:
PJXHYRWSZICBHI-UHFFFAOYSA-N
SMILES:
Clc1cc(Br)c[n+](c1)[O-]
Properties
Complexity:
103
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.909g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.439g/mol
Monoisotopic Mass:
206.909g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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