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260417-56-9 | Methanone, (2-bromo-4-pyridinyl)-3-pyridinyl-
CAS No: 260417-56-9 Catalog No: AG002RGW MDL No:
Product Description
Catalog Number:
AG002RGW
Chemical Name:
Methanone, (2-bromo-4-pyridinyl)-3-pyridinyl-
CAS Number:
260417-56-9
Molecular Formula:
C11H7BrN2O
Molecular Weight:
263.0901
IUPAC Name:
(2-bromopyridin-4-yl)-pyridin-3-ylmethanone
InChI:
InChI=1S/C11H7BrN2O/c12-10-6-8(3-5-14-10)11(15)9-2-1-4-13-7-9/h1-7H
InChI Key:
IOVJKGWSRSFDRT-UHFFFAOYSA-N
SMILES:
Brc1nccc(c1)C(=O)c1cccnc1
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.974g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.094g/mol
Monoisotopic Mass:
261.974g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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