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(1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) 2-cyclopentyl-2-hydroxy-2-phenylacetate;bromide

(1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) 2-cyclopentyl-2-hydroxy-2-phenylacetate;bromide structure

CAS No:
29125-57-3
Formula:
C21H30BrNO3
Chemical Name:
(1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) 2-cyclopentyl-2-hydroxy-2-phenylacetate;bromide
Synonyms:
29125-57-3;3-Hydroxy-1-methylquinuclidinium bromide alpha-cyclopentylmandelate;Quinuclidinium, 3-hydroxy-1-methyl-, bromide, alpha-cyclopentylmandelate;1-Methyl-3-(2-cyclopentyl-2-hydroxy-2-phenylethanoyloxy)quinuclidinium bromide;DTXSID60951726;3-{[Cyclopentyl(hydroxy)phenylacetyl]oxy}-1-methyl-1-azabicyclo[2.2.2]octan-1-ium bromide

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(1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) 2-cyclopentyl-2-hydroxy-2-phenylacetate;bromide Basic Attributes

Molecular Weight：

424.4 g/mol

Exact Mass：

423.14091 g/mol

Characteristics

PSA：

46.5 Å²

Computed Properties

Molecular Weight:424.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:423.14091
Monoisotopic Mass:423.14091
Topological Polar Surface Area:46.5
Heavy Atom Count:26
Complexity:487
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of (1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) 2-cyclopentyl-2-hydroxy-2-phenylacetate;bromide

Basic Attributes
Characteristics
Computed Properties
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