3-[[methyl(2-phenylethyl)amino]methyl]-3H-2-benzothiophen-1-one,oxalic acid
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![3-[[methyl(2-phenylethyl)amino]methyl]-3H-2-benzothiophen-1-one,oxalic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/abe75f48fd384487a7b6a4397db8251a.png "3-[[methyl(2-phenylethyl)amino]methyl]-3H-2-benzothiophen-1-one,oxalic acid")
3-[[methyl(2-phenylethyl)amino]methyl]-3H-2-benzothiophen-1-one,oxalic acid
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CAS No:
97874-33-4
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Formula:
C20H21NO5S
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Chemical Name:
3-[[methyl(2-phenylethyl)amino]methyl]-3H-2-benzothiophen-1-one,oxalic acid
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Synonyms:
3-[[methyl(phenethyl)amino]methyl]-3H-2-benzothiophen-1-one; Benzo(c)thiophen-1(3H)-one,3-((methyl(2-phenylethyl)amino)methyl)-,ethanedioate (1:1); 3-((Methyl(2-phenylethyl)amino)methyl)benzo(c)thiophen-1(3H)-one ethanedioate (1:1); 9-[(methyl-phenethyl-amino)methyl]-8-thiabicyclo[4.3.0]nona-1,3,5-trien-7-one;
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CAS No:
3-[[methyl(2-phenylethyl)amino]methyl]-3H-2-benzothiophen-1-one,oxalic acid Basic Attributes
387.44900
387.11404394
Computed Properties
Molecular Weight:387.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:387.11404394
Monoisotopic Mass:387.11404394
Topological Polar Surface Area:120
Heavy Atom Count:27
Complexity:425
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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