CAS
97536-45-3 Purity
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97536-45-3 Purity
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Specification
The molecular formula is C16H14O4.
Some synonyms include methyl 3-oxo-3-(2-phenoxyphenyl)propanoate and 3-Oxo-3-(2-phenoxyphenyl)propionic acid methyl ester.
It was created on July 19, 2005.
The molecular weight is 270.28 g/mol.
The InChIKey is UGFFEICICOBKHD-UHFFFAOYSA-N.
It has 4 hydrogen bond acceptors.
The XLogP3-AA value is 3.2.
The topological polar surface area is 52.6 Å2.
It has 6 rotatable bonds.
Yes, the compound is canonicalized.