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73087-17-9 | 5(4H)-Oxazolone, 2-(phenylmethoxy)-4-(phenylmethyl)-
CAS No: 73087-17-9 Catalog No: AG005MC4 MDL No:
Product Description
Catalog Number:
AG005MC4
Chemical Name:
5(4H)-Oxazolone, 2-(phenylmethoxy)-4-(phenylmethyl)-
CAS Number:
73087-17-9
Molecular Formula:
C17H15NO3
Molecular Weight:
281.3059
IUPAC Name:
4-benzyl-2-phenylmethoxy-4H-1,3-oxazol-5-one
InChI:
InChI=1S/C17H15NO3/c19-16-15(11-13-7-3-1-4-8-13)18-17(21-16)20-12-14-9-5-2-6-10-14/h1-10,15H,11-12H2
InChI Key:
KXQCTTDKDDNZSA-UHFFFAOYSA-N
SMILES:
O=C1OC(=NC1Cc1ccccc1)OCc1ccccc1
Properties
Complexity:
382
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.105g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
281.311g/mol
Monoisotopic Mass:
281.105g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
47.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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