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94662-28-9 | Phenol, 4-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)-2-nitro-
CAS No: 94662-28-9 Catalog No: AG006TRD MDL No:
Product Description
Catalog Number:
AG006TRD
Chemical Name:
Phenol, 4-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)-2-nitro-
CAS Number:
94662-28-9
Molecular Formula:
C15H13N3O3
Molecular Weight:
283.2820
IUPAC Name:
4-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)-2-nitrophenol
InChI:
InChI=1S/C15H13N3O3/c1-9-5-6-17-10(2)15(16-14(17)7-9)11-3-4-13(19)12(8-11)18(20)21/h3-8,19H,1-2H3
InChI Key:
FYBUGLDJURUPSV-UHFFFAOYSA-N
SMILES:
Cc1ccn2c(c1)nc(c2C)c1ccc(c(c1)[N+](=O)[O-])O
Properties
Complexity:
400
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.096g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
283.287g/mol
Monoisotopic Mass:
283.096g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
83.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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