1-[7-[3-[(1,1-Dimethylethyl)amino]-2-hydroxypropoxy]-2-benzofuranyl]ethanone
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1-[7-[3-[(1,1-Dimethylethyl)amino]-2-hydroxypropoxy]-2-benzofuranyl]ethanone
structure -
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CAS No:
39543-80-1
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Formula:
C17H23NO4
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Chemical Name:
1-[7-[3-[(1,1-Dimethylethyl)amino]-2-hydroxypropoxy]-2-benzofuranyl]ethanone
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Synonyms:
Ethanone,1-[7-[3-[(1,1-dimethylethyl)amino]-2-hydroxypropoxy]-2-benzofuranyl]-;1-[7-[3-[(1,1-Dimethylethyl)amino]-2-hydroxypropoxy]-2-benzofuranyl]ethanone;2-Acetyl-7-(2-hydroxy-3-tert-butylaminopropoxy)benzofuran;BFE 61
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CAS No:
1-[7-[3-[(1,1-Dimethylethyl)amino]-2-hydroxypropoxy]-2-benzofuranyl]ethanone Basic Attributes
305.374
305.37
Characteristics
71.7
2.2
1.0817 (rough estimate)
Intravenous-Mouse LD50: 45 mg/kg
Flammable; decomposes by heating to release toxic nitrogen oxide fumes
Computed Properties
Molecular Weight:305.4
XLogP3:2.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:305.16270821
Monoisotopic Mass:305.16270821
Topological Polar Surface Area:71.7
Heavy Atom Count:22
Complexity:379
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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1-[7-[3-[(1,1-Dimethylethyl)amino]-2-hydroxypropoxy]-2-benzofuranyl]ethanone
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