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7497-52-1 | 2-Chloroacridin-9(10H)-one
CAS No: 7497-52-1 Catalog No: AG003H1C MDL No:MFCD00223258
Product Description
Catalog Number:
AG003H1C
Chemical Name:
2-Chloroacridin-9(10H)-one
CAS Number:
7497-52-1
Molecular Formula:
C13H8ClNO
Molecular Weight:
229.6617
MDL Number:
MFCD00223258
IUPAC Name:
2-chloro-10H-acridin-9-one
InChI:
InChI=1S/C13H8ClNO/c14-8-5-6-12-10(7-8)13(16)9-3-1-2-4-11(9)15-12/h1-7H,(H,15,16)
InChI Key:
WNLFUMVKGWEXBI-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)c(=O)c1c([nH]2)cccc1
NSC Number:
406615
Properties
Complexity:
294
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.029g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
229.663g/mol
Monoisotopic Mass:
229.029g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
Literature
| Title | Journal |
|---|---|
| Acridones circumvent P-glycoprotein-associated multidrug resistance (MDR) in cancer cells. | Bioorganic & medicinal chemistry 20080101 |
| A rapid fluorimetric screening method for the 1,4-benzodiazepines: determination of their metabolite oxazepam in urine. | Analytica chimica acta 20070515 |
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