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96829-91-3 | Methanone, (4-methoxyphenyl)(5-phenyl-2-oxazolyl)-
CAS No: 96829-91-3 Catalog No: AG006669 MDL No:
Product Description
Catalog Number:
AG006669
Chemical Name:
Methanone, (4-methoxyphenyl)(5-phenyl-2-oxazolyl)-
CAS Number:
96829-91-3
Molecular Formula:
C17H13NO3
Molecular Weight:
279.2900
IUPAC Name:
(4-methoxyphenyl)-(5-phenyl-1,3-oxazol-2-yl)methanone
InChI:
InChI=1S/C17H13NO3/c1-20-14-9-7-13(8-10-14)16(19)17-18-11-15(21-17)12-5-3-2-4-6-12/h2-11H,1H3
InChI Key:
GDNGHUCFCYOZLS-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C(=O)c1ncc(o1)c1ccccc1
Properties
Complexity:
346
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:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.295g/mol
Monoisotopic Mass:
279.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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