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101067-53-2 | 2-Azetidinone, 4-(4-methoxyphenyl)-3-phenoxy-
CAS No: 101067-53-2 Catalog No: AG0003NF MDL No:
Product Description
Catalog Number:
AG0003NF
Chemical Name:
2-Azetidinone, 4-(4-methoxyphenyl)-3-phenoxy-
CAS Number:
101067-53-2
Molecular Formula:
C16H15NO3
Molecular Weight:
269.2952
IUPAC Name:
4-(4-methoxyphenyl)-3-phenoxyazetidin-2-one
InChI:
InChI=1S/C16H15NO3/c1-19-12-9-7-11(8-10-12)14-15(16(18)17-14)20-13-5-3-2-4-6-13/h2-10,14-15H,1H3,(H,17,18)
InChI Key:
XHNJVXANPWVHGV-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C1NC(=O)C1Oc1ccccc1
Properties
Complexity:
333
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.105g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
269.3g/mol
Monoisotopic Mass:
269.105g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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