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31521-98-9 | 7-Methyl-2-(4-nitro-phenyl)-imidazo[1,2-a]pyridine -3-carbaldehyde
CAS No: 31521-98-9 Catalog No: AG01F2B4 MDL No:
Product Description
Catalog Number:
AG01F2B4
Chemical Name:
7-Methyl-2-(4-nitro-phenyl)-imidazo[1,2-a]pyridine -3-carbaldehyde
CAS Number:
31521-98-9
Molecular Formula:
C15H11N3O3
Molecular Weight:
281.2661
IUPAC Name:
7-methyl-2-(4-nitrophenyl)imidazo[1,2-a]pyridine-3-carbaldehyde
InChI:
InChI=1S/C15H11N3O3/c1-10-6-7-17-13(9-19)15(16-14(17)8-10)11-2-4-12(5-3-11)18(20)21/h2-9H,1H3
InChI Key:
FJULGNDKGMLSGJ-UHFFFAOYSA-N
SMILES:
O=Cc1c(nc2n1ccc(c2)C)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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