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1070879-76-3 | 7,8-Dimethyl-2-phenyl-4-quinolinol
CAS No: 1070879-76-3 Catalog No: AG007B64 MDL No:
Product Description
Catalog Number:
AG007B64
Chemical Name:
7,8-Dimethyl-2-phenyl-4-quinolinol
CAS Number:
1070879-76-3
Molecular Formula:
C17H15NO
Molecular Weight:
249.3071
IUPAC Name:
7,8-dimethyl-2-phenyl-1H-quinolin-4-one
InChI:
InChI=1S/C17H15NO/c1-11-8-9-14-16(19)10-15(18-17(14)12(11)2)13-6-4-3-5-7-13/h3-10H,1-2H3,(H,18,19)
InChI Key:
HQEYFAQMBUDTKC-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1C)[nH]c(cc2=O)c1ccccc1
Properties
Complexity:
381
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.115g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
249.313g/mol
Monoisotopic Mass:
249.115g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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