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122105-95-7 | 9(10H)-Acridinone, 3,6-dihydroxy-
CAS No: 122105-95-7 Catalog No: AG0016R4 MDL No:
Product Description
Catalog Number:
AG0016R4
Chemical Name:
9(10H)-Acridinone, 3,6-dihydroxy-
CAS Number:
122105-95-7
Molecular Formula:
C13H9NO3
Molecular Weight:
227.2155
IUPAC Name:
3,6-dihydroxy-10H-acridin-9-one
InChI:
InChI=1S/C13H9NO3/c15-7-1-3-9-11(5-7)14-12-6-8(16)2-4-10(12)13(9)17/h1-6,15-16H,(H,14,17)
InChI Key:
PVRYFKGBOYVWMN-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)[nH]c1c(c2=O)ccc(c1)O
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.058g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
227.219g/mol
Monoisotopic Mass:
227.058g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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