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89070-55-3 | Benzenamine, N-[(6-methoxy-2-quinolinyl)methylene]-4-methyl-
CAS No: 89070-55-3 Catalog No: AG0040AL MDL No:
Product Description
Catalog Number:
AG0040AL
Chemical Name:
Benzenamine, N-[(6-methoxy-2-quinolinyl)methylene]-4-methyl-
CAS Number:
89070-55-3
Molecular Formula:
C18H16N2O
Molecular Weight:
276.3324
IUPAC Name:
1-(6-methoxyquinolin-2-yl)-N-(4-methylphenyl)methanimine
InChI:
InChI=1S/C18H16N2O/c1-13-3-6-15(7-4-13)19-12-16-8-5-14-11-17(21-2)9-10-18(14)20-16/h3-12H,1-2H3
InChI Key:
HBBMVOYLQUNHNR-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)ccc(n2)C=Nc1ccc(cc1)C
Properties
Complexity:
349
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.126g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.339g/mol
Monoisotopic Mass:
276.126g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
34.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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