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727975-80-6 | 6-Methyl-2-(4-nitro-phenyl)-imidazo[1,2-a]-pyridine-3-carbaldehyde
CAS No: 727975-80-6 Catalog No: AG01EX67 MDL No:
Product Description
Catalog Number:
AG01EX67
Chemical Name:
6-Methyl-2-(4-nitro-phenyl)-imidazo[1,2-a]-pyridine-3-carbaldehyde
CAS Number:
727975-80-6
Molecular Formula:
C15H11N3O3
Molecular Weight:
281.2661
IUPAC Name:
6-methyl-2-(4-nitrophenyl)imidazo[1,2-a]pyridine-3-carbaldehyde
InChI:
InChI=1S/C15H11N3O3/c1-10-2-7-14-16-15(13(9-19)17(14)8-10)11-3-5-12(6-4-11)18(20)21/h2-9H,1H3
InChI Key:
NAOIFZMTEGMMGD-UHFFFAOYSA-N
SMILES:
O=Cc1c(nc2n1cc(C)cc2)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
404
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.08g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
281.271g/mol
Monoisotopic Mass:
281.08g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
80.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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