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871577-15-0 | 9,10-Anthracenedione, 1-methyl-2-(3-oxobutyl)-
CAS No: 871577-15-0 Catalog No: AG004T9W MDL No:
Product Description
Catalog Number:
AG004T9W
Chemical Name:
9,10-Anthracenedione, 1-methyl-2-(3-oxobutyl)-
CAS Number:
871577-15-0
Molecular Formula:
C19H16O3
Molecular Weight:
292.3285
IUPAC Name:
1-methyl-2-(3-oxobutyl)anthracene-9,10-dione
InChI:
InChI=1S/C19H16O3/c1-11(20)7-8-13-9-10-16-17(12(13)2)19(22)15-6-4-3-5-14(15)18(16)21/h3-6,9-10H,7-8H2,1-2H3
InChI Key:
ATBNRRNSAIGYLC-UHFFFAOYSA-N
SMILES:
CC(=O)CCc1ccc2c(c1C)C(=O)c1c(C2=O)cccc1
Properties
Complexity:
481
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.11g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
292.334g/mol
Monoisotopic Mass:
292.11g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
Literature
| Title | Journal |
|---|---|
| Anthraquinones from the stem bark of Stereospermum zenkeri with antimicrobial activity. | Phytochemistry 20070601 |
| Free-radical-scavenging and xanthine oxidase inhibitory constituents from Stereospermum personatum. | Journal of natural products 20051101 |
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