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14415-44-2 | 2H-1-Benzopyran-2-one, 6-amino-
CAS No: 14415-44-2 Catalog No: AG001J06 MDL No:MFCD00115435
Product Description
Catalog Number:
AG001J06
Chemical Name:
2H-1-Benzopyran-2-one, 6-amino-
CAS Number:
14415-44-2
Molecular Formula:
C9H7NO2
Molecular Weight:
161.1574
MDL Number:
MFCD00115435
IUPAC Name:
6-aminochromen-2-one
InChI:
InChI=1S/C9H7NO2/c10-7-2-3-8-6(5-7)1-4-9(11)12-8/h1-5H,10H2
InChI Key:
ZOJAINJCZSVZGW-UHFFFAOYSA-N
SMILES:
Nc1ccc2c(c1)ccc(=O)o2
UNII:
S9W3L9R2NA
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.048g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
161.16g/mol
Monoisotopic Mass:
161.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
Literature
| Title | Journal |
|---|---|
| Radiationless deactivation of 6-aminocoumarin from the S1-ICT state in nonspecifically interacting solvents. | Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 20120801 |
| Design, synthesis and vasorelaxant evaluation of novel coumarin-pyrimidine hybrids. | Bioorganic & medicinal chemistry 20111015 |
| Changes in energy of three types of hydrogen bonds upon excitation of aminocoumarins determined from absorption solvatochromic experiments. | Physical chemistry chemical physics : PCCP 20110621 |
| Structure, photophysics, electrochemistry, DFT calculation, and in-vitro antioxidant activity of coumarin Schiff base complexes of Group 6 metal carbonyls. | Journal of inorganic biochemistry 20110401 |
| Synthesis of novel biologically active heterocyclic compounds from 2-oxo-2H-benzopyran-6-yl-imidazolidine. | Acta poloniae pharmaceutica 20110101 |
| Synthesis of biologically active 1'-(2-oxo-2H-benzopyran-6-yl)- 5'-hydroxy-2'-methylindole-3'-amido-2'-phenyl-thiazolidene-4'-ones. | Acta poloniae pharmaceutica 20110101 |
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| Micronucleus induction and chromosomal aberration of 1- and 3-nitroazabenzo[a]pyrene and their N-oxides. | Mutagenesis 20010501 |
| Inhibition of HIV-1 IIIb replication in AA-2 and MT-2 cells in culture by two ligands of poly (ADP-ribose) polymerase: 6-amino-1,2-benzopyrone and 5-iodo-6-amino-1,2-benzopyrone. | Biochemical and biophysical research communications 19911031 |
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