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16216-08-3 | Ethanone, 2-(1-naphthalenyl)-1-phenyl-
CAS No: 16216-08-3 Catalog No: AG001SU1 MDL No:MFCD16350230
Product Description
Catalog Number:
AG001SU1
Chemical Name:
Ethanone, 2-(1-naphthalenyl)-1-phenyl-
CAS Number:
16216-08-3
Molecular Formula:
C18H14O
Molecular Weight:
246.3032
MDL Number:
MFCD16350230
IUPAC Name:
2-naphthalen-1-yl-1-phenylethanone
InChI:
InChI=1S/C18H14O/c19-18(15-8-2-1-3-9-15)13-16-11-6-10-14-7-4-5-12-17(14)16/h1-12H,13H2
InChI Key:
NXRAJMQCFRMHKG-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)Cc1cccc2c1cccc2
Properties
Complexity:
303
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.104g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.309g/mol
Monoisotopic Mass:
246.104g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
Literature
| Title | Journal |
|---|---|
| Naphthylchalcones induce apoptosis and caspase activation in a leukemia cell line: The relationship between mitochondrial damage, oxidative stress, and cell death. | Bioorganic & medicinal chemistry 20101115 |
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