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124903-84-0 | Benzo[b]phenanthridine-7,12-dione, 1,8-dihydroxy-3-methyl-
CAS No: 124903-84-0 Catalog No: AG000MW0 MDL No:
Product Description
Catalog Number:
AG000MW0
Chemical Name:
Benzo[b]phenanthridine-7,12-dione, 1,8-dihydroxy-3-methyl-
CAS Number:
124903-84-0
Molecular Formula:
C18H11NO4
Molecular Weight:
305.2842
IUPAC Name:
1,8-dihydroxy-3-methylbenzo[b]phenanthridine-7,12-dione
InChI:
InChI=1S/C18H11NO4/c1-8-5-9-7-19-16-15(13(9)12(21)6-8)17(22)10-3-2-4-11(20)14(10)18(16)23/h2-7,20-21H,1H3
InChI Key:
YUPGXNABNFYQMU-UHFFFAOYSA-N
SMILES:
Cc1cc(O)c2c(c1)cnc1c2C(=O)c2cccc(c2C1=O)O
Properties
Complexity:
521
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.069g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
305.289g/mol
Monoisotopic Mass:
305.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
87.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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