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89060-15-1 | Ethanone, 1-[4-[(6-quinolinylmethylene)amino]phenyl]-
CAS No: 89060-15-1 Catalog No: AG00411H MDL No:
Product Description
Catalog Number:
AG00411H
Chemical Name:
Ethanone, 1-[4-[(6-quinolinylmethylene)amino]phenyl]-
CAS Number:
89060-15-1
Molecular Formula:
C18H14N2O
Molecular Weight:
274.3166
IUPAC Name:
1-[4-(quinolin-6-ylmethylideneamino)phenyl]ethanone
InChI:
InChI=1S/C18H14N2O/c1-13(21)15-5-7-17(8-6-15)20-12-14-4-9-18-16(11-14)3-2-10-19-18/h2-12H,1H3
InChI Key:
FZFHAGFINCHXFY-UHFFFAOYSA-N
SMILES:
CC(=O)c1ccc(cc1)N=Cc1ccc2c(c1)cccn2
Properties
Complexity:
385
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.111g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.323g/mol
Monoisotopic Mass:
274.111g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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