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885276-47-1 | Methyl 6-nitro-3-phenylimidazo[1,2-a]pyridine-2-carboxylate
CAS No: 885276-47-1 Catalog No: AG0045G3 MDL No:MFCD06739202
Product Description
Catalog Number:
AG0045G3
Chemical Name:
Methyl 6-nitro-3-phenylimidazo[1,2-a]pyridine-2-carboxylate
CAS Number:
885276-47-1
Molecular Formula:
C15H11N3O4
Molecular Weight:
297.2655
MDL Number:
MFCD06739202
IUPAC Name:
methyl 6-nitro-3-phenylimidazo[1,2-a]pyridine-2-carboxylate
InChI:
InChI=1S/C15H11N3O4/c1-22-15(19)13-14(10-5-3-2-4-6-10)17-9-11(18(20)21)7-8-12(17)16-13/h2-9H,1H3
InChI Key:
FHYNTIUTGDLUND-UHFFFAOYSA-N
SMILES:
COC(=O)c1nc2n(c1c1ccccc1)cc(cc2)[N+](=O)[O-]
Properties
Complexity:
433
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.075g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.27g/mol
Monoisotopic Mass:
297.075g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
89.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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