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727652-12-2 | 6-Bromo-2-(4-nitro-phenyl)-imidazo[1,2-a]pyridine-3-carbaldehyde
CAS No: 727652-12-2 Catalog No: AG01EX57 MDL No:
Product Description
Catalog Number:
AG01EX57
Chemical Name:
6-Bromo-2-(4-nitro-phenyl)-imidazo[1,2-a]pyridine-3-carbaldehyde
CAS Number:
727652-12-2
Molecular Formula:
C14H8BrN3O3
Molecular Weight:
346.1356
IUPAC Name:
6-bromo-2-(4-nitrophenyl)imidazo[1,2-a]pyridine-3-carbaldehyde
InChI:
InChI=1S/C14H8BrN3O3/c15-10-3-6-13-16-14(12(8-19)17(13)7-10)9-1-4-11(5-2-9)18(20)21/h1-8H
InChI Key:
AREAMAISAIURHY-UHFFFAOYSA-N
SMILES:
O=Cc1c(nc2n1cc(Br)cc2)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
409
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.975g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
346.14g/mol
Monoisotopic Mass:
344.975g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
80.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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