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Home > Indoles and Oxindole > 76148-99-7
76148-99-7 | 1H-Benz[f]indole-4,9-dione, 2-(4-methoxyphenyl)-
CAS No: 76148-99-7 Catalog No: AG005FF7 MDL No:
Product Description
Catalog Number:
AG005FF7
Chemical Name:
1H-Benz[f]indole-4,9-dione, 2-(4-methoxyphenyl)-
CAS Number:
76148-99-7
Molecular Formula:
C19H13NO3
Molecular Weight:
303.3114
IUPAC Name:
2-(4-methoxyphenyl)-1H-benzo[f]indole-4,9-dione
InChI:
InChI=1S/C19H13NO3/c1-23-12-8-6-11(7-9-12)16-10-15-17(20-16)19(22)14-5-3-2-4-13(14)18(15)21/h2-10,20H,1H3
InChI Key:
VHARHIVHIZRWCG-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1cc2c([nH]1)C(=O)c1c(C2=O)cccc1
Properties
Complexity:
483
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.09g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
303.317g/mol
Monoisotopic Mass:
303.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
59.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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