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16352-74-2 | 5(4H)-Oxazolone, 4-[(2-chlorophenyl)methylene]-2-(4-methylphenyl)-
CAS No: 16352-74-2 Catalog No: AG001U7C MDL No:
Product Description
Catalog Number:
AG001U7C
Chemical Name:
5(4H)-Oxazolone, 4-[(2-chlorophenyl)methylene]-2-(4-methylphenyl)-
CAS Number:
16352-74-2
Molecular Formula:
C17H12ClNO2
Molecular Weight:
297.7357
IUPAC Name:
4-[(2-chlorophenyl)methylidene]-2-(4-methylphenyl)-1,3-oxazol-5-one
InChI:
InChI=1S/C17H12ClNO2/c1-11-6-8-12(9-7-11)16-19-15(17(20)21-16)10-13-4-2-3-5-14(13)18/h2-10H,1H3
InChI Key:
GDOGSFJWIVSVBQ-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)C1=NC(=Cc2ccccc2Cl)C(=O)O1
Properties
Complexity:
463
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.056g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.738g/mol
Monoisotopic Mass:
297.056g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.6
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