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Home > Nitro Compounds > 19725-49-6
19725-49-6 | 4H-1-Benzopyran-4-one, 2-(4-nitrophenyl)-
CAS No: 19725-49-6 Catalog No: AG002AP3 MDL No:MFCD00208237
Product Description
Catalog Number:
AG002AP3
Chemical Name:
4H-1-Benzopyran-4-one, 2-(4-nitrophenyl)-
CAS Number:
19725-49-6
Molecular Formula:
C15H9NO4
Molecular Weight:
267.2363
MDL Number:
MFCD00208237
IUPAC Name:
2-(4-nitrophenyl)chromen-4-one
InChI:
InChI=1S/C15H9NO4/c17-13-9-15(20-14-4-2-1-3-12(13)14)10-5-7-11(8-6-10)16(18)19/h1-9H
InChI Key:
CKSVYVHLZNMXLX-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)c1cc(=O)c2c(o1)cccc2
Properties
Complexity:
432
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.053g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.24g/mol
Monoisotopic Mass:
267.053g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
Literature
| Title | Journal |
|---|---|
| Antitumor activity of some natural flavonoids and synthetic derivatives on various human and murine cancer cell lines. | Bioorganic & medicinal chemistry 20060501 |
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