(1,1-dimethylpyrrolidin-1-ium-3-yl) 2-hydroxy-2-phenyl-2-thiophen-2-ylacetate
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(1,1-dimethylpyrrolidin-1-ium-3-yl) 2-hydroxy-2-phenyl-2-thiophen-2-ylacetate
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CAS No:
21379-80-6
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Formula:
C18H22NO3S+
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Chemical Name:
(1,1-dimethylpyrrolidin-1-ium-3-yl) 2-hydroxy-2-phenyl-2-thiophen-2-ylacetate
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Synonyms:
heteronium;heteronium bromide;Heteronium;UNII-2FN14CSE90;2FN14CSE90;SCHEMBL249397;CHEMBL2110853;Q27254686;Pyrrolidinium, 3-((hydroxyphenyl-2-thienylacetyl)oxy)-1,1-dimethyl-;(+/-)-3-Hydroxy-1,1-dimethylpyrrolidinium alpha-phenyl-2-thiopheneglycolate;(1,1-Dimethylpyrrolidin-1-ium-3-yl)2-hydroxy-2-phenyl-2-thiophen-2-ylacetate bromide;alphabeta-(+/-)-(1-methyl-3-pyrrolidinyl) alpha-phenyl-alpha-(2-thienyl)glycolate;Pyrrolidinium, 3-((2-hydroxy-2-phenyl-2-(2-thienyl)acetyl)oxy)-1,1-dimethyl-;21379-80-6
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CAS No:
(1,1-dimethylpyrrolidin-1-ium-3-yl) 2-hydroxy-2-phenyl-2-thiophen-2-ylacetate Basic Attributes
332.4 g/mol
332.13203974 g/mol
2FN14CSE90
Computed Properties
Molecular Weight:332.4
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:332.13203974
Monoisotopic Mass:332.13203974
Topological Polar Surface Area:74.8
Heavy Atom Count:23
Formal Charge:1
Complexity:436
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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(1,1-dimethylpyrrolidin-1-ium-3-yl) 2-cyclohexyl-2-hydroxy-2-phenylacetate
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(1,1-dimethylpyrrolidin-1-ium-3-yl) 2-hydroxy-2,2-diphenylacetate
765836-13-3
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(1,1-dimethylpyrrolidin-1-ium-3-yl) 2-cyclopentyl-2-hydroxy-2-phenylacetate
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(1-methylpiperidin-3-yl) 2-hydroxy-2-phenyl-2-thiophen-2-ylacetate Formula
63917-18-0
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(1,1-dimethylpyrrolidin-1-ium-3-yl) 2-hydroxy-2,2-diphenylacetate;bromide Formula
13696-15-6
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