α-[(Acetyloxy)methyl]benzenepropanoic acid
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![α-[(Acetyloxy)methyl]benzenepropanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/df30f479d1614819a6bca574fb3f4c72.png "α-[(Acetyloxy)methyl]benzenepropanoic acid")
α-[(Acetyloxy)methyl]benzenepropanoic acid
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CAS No:
187610-68-0
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Formula:
C12H14O4
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Chemical Name:
α-[(Acetyloxy)methyl]benzenepropanoic acid
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Synonyms:
Benzenepropanoic acid,α-[(acetyloxy)methyl]-;α-[(Acetyloxy)methyl]benzenepropanoic acid;2-Acetoxymethyl-3-phenylpropionic acid;3-Acetoxy-2-benzylpropanoic acid;139756-86-8
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CAS No:
Computed Properties
Molecular Weight:222.24
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:222.08920892
Monoisotopic Mass:222.08920892
Topological Polar Surface Area:63.6
Heavy Atom Count:16
Complexity:243
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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α-[(Acetyloxy)methyl]benzenepropanoic acid
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