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100523-96-4 | Pyridine, 2-bromo-4-iodo-
CAS No: 100523-96-4 Catalog No: AG000298 MDL No:MFCD03085768
Product Description
Catalog Number:
AG000298
Chemical Name:
Pyridine, 2-bromo-4-iodo-
CAS Number:
100523-96-4
Molecular Formula:
C5H3BrIN
Molecular Weight:
283.8925
MDL Number:
MFCD03085768
IUPAC Name:
2-bromo-4-iodopyridine
InChI:
InChI=1S/C5H3BrIN/c6-5-3-4(7)1-2-8-5/h1-3H
InChI Key:
HPKRNLGLZYOVJS-UHFFFAOYSA-N
SMILES:
Ic1ccnc(c1)Br
Properties
Complexity:
78.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.849g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.894g/mol
Monoisotopic Mass:
282.849g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
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