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77761-41-2 | 2(1H)-Naphthalenone, 1-[[(4-methylphenyl)amino]methylene]-
CAS No: 77761-41-2 Catalog No: AG005G1G MDL No:
Product Description
Catalog Number:
AG005G1G
Chemical Name:
2(1H)-Naphthalenone, 1-[[(4-methylphenyl)amino]methylene]-
CAS Number:
77761-41-2
Molecular Formula:
C18H15NO
Molecular Weight:
261.3178
IUPAC Name:
1-[(4-methylphenyl)iminomethyl]naphthalen-2-ol
InChI:
InChI=1S/C18H15NO/c1-13-6-9-15(10-7-13)19-12-17-16-5-3-2-4-14(16)8-11-18(17)20/h2-12,20H,1H3
InChI Key:
FLLXNRWVERXYJX-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)NC=C1C(=O)C=Cc2c1cccc2
NSC Number:
47921
Properties
Complexity:
332
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.115g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
261.324g/mol
Monoisotopic Mass:
261.115g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
32.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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