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828929-09-5 | Pyridine, 2-(4-bromo-2-furanyl)-
CAS No: 828929-09-5 Catalog No: AG004VTJ MDL No:
Product Description
Catalog Number:
AG004VTJ
Chemical Name:
Pyridine, 2-(4-bromo-2-furanyl)-
CAS Number:
828929-09-5
Molecular Formula:
C9H6BrNO
Molecular Weight:
224.0540
IUPAC Name:
2-(4-bromofuran-2-yl)pyridine
InChI:
InChI=1S/C9H6BrNO/c10-7-5-9(12-6-7)8-3-1-2-4-11-8/h1-6H
InChI Key:
KGKAFMMOTOBORH-UHFFFAOYSA-N
SMILES:
Brc1coc(c1)c1ccccn1
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.963g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.057g/mol
Monoisotopic Mass:
222.963g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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