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95378-74-8 | 1H-Indene-1,3(2H)-dione, 2-(6,7-dimethyl-2-quinolinyl)-
CAS No: 95378-74-8 Catalog No: AG005S2L MDL No:
Product Description
Catalog Number:
AG005S2L
Chemical Name:
1H-Indene-1,3(2H)-dione, 2-(6,7-dimethyl-2-quinolinyl)-
CAS Number:
95378-74-8
Molecular Formula:
C20H15NO2
Molecular Weight:
301.3386
IUPAC Name:
2-(6,7-dimethylquinolin-2-yl)indene-1,3-dione
InChI:
InChI=1S/C20H15NO2/c1-11-9-13-7-8-16(21-17(13)10-12(11)2)18-19(22)14-5-3-4-6-15(14)20(18)23/h3-10,18H,1-2H3
InChI Key:
ASJNRJHXNHEYQO-UHFFFAOYSA-N
SMILES:
O=C1C(c2ccc3c(n2)cc(c(c3)C)C)C(=O)c2c1cccc2
Properties
Complexity:
478
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.11g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
301.345g/mol
Monoisotopic Mass:
301.11g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
47A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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