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89332-59-2 | 2(3H)-Oxazolone, 3-(diphenylacetyl)-
CAS No: 89332-59-2 Catalog No: AG003ZJY MDL No:
Product Description
Catalog Number:
AG003ZJY
Chemical Name:
2(3H)-Oxazolone, 3-(diphenylacetyl)-
CAS Number:
89332-59-2
Molecular Formula:
C17H13NO3
Molecular Weight:
279.2900
IUPAC Name:
3-(2,2-diphenylacetyl)-1,3-oxazol-2-one
InChI:
InChI=1S/C17H13NO3/c19-16(18-11-12-21-17(18)20)15(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-12,15H
InChI Key:
MZLKTNURJGBPDC-UHFFFAOYSA-N
SMILES:
O=C(n1ccoc1=O)C(c1ccccc1)c1ccccc1
Properties
Complexity:
402
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.09g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.295g/mol
Monoisotopic Mass:
279.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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