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69015-82-3 | 5(4H)-Oxazolone, 4-[1-(4-methoxyphenyl)ethylidene]-2-phenyl-, (Z)-
CAS No: 69015-82-3 Catalog No: AG005M61 MDL No:
Product Description
Catalog Number:
AG005M61
Chemical Name:
5(4H)-Oxazolone, 4-[1-(4-methoxyphenyl)ethylidene]-2-phenyl-, (Z)-
CAS Number:
69015-82-3
Molecular Formula:
C18H15NO3
Molecular Weight:
293.3166
IUPAC Name:
4-[1-(4-methoxyphenyl)ethylidene]-2-phenyl-1,3-oxazol-5-one
InChI:
InChI=1S/C18H15NO3/c1-12(13-8-10-15(21-2)11-9-13)16-18(20)22-17(19-16)14-6-4-3-5-7-14/h3-11H,1-2H3
InChI Key:
KWJOUDYKPRVRCO-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)/C(=C/1\N=C(OC1=O)c1ccccc1)/C
Properties
Complexity:
481
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.105g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
293.322g/mol
Monoisotopic Mass:
293.105g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
47.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.2
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