3-(1-benzofuran-2-yl)-2,2-dimethylpentanoic acid
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3-(1-benzofuran-2-yl)-2,2-dimethylpentanoic acid
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CAS No:
72236-76-1
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Formula:
C15H18O3
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Chemical Name:
3-(1-benzofuran-2-yl)-2,2-dimethylpentanoic acid
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Synonyms:
3-(2-benzofuranyl)-2,2-dimethyl-3-ethylpropionic acid;72236-76-1;beta-ethyl-alpha,alpha-dimethyl-2-benzofuranpropanoic acid;BRN 4457212;3-(2-Benzofuranyl)-2,2-dimethyl-3-ethylpropionic acid;alpha,alpha-Dimethyl-beta-ethyl-2-benzofuranpropanoic acid;3-(1-benzofuran-2-yl)-2,2-dimethylpentanoic acid;DTXSID40992970;2-BENZOFURANPROPANOIC ACID, alpha,alpha-DIMETHYL-beta-ETHYL-;Q27291992;alpha,alpha-Dimethyl-beta-ethyl-2-benzofuranpropionic acid
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CAS No:
Computed Properties
Molecular Weight:246.30
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:246.125594432
Monoisotopic Mass:246.125594432
Topological Polar Surface Area:50.4
Heavy Atom Count:18
Complexity:311
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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