(E)-but-2-enedioic acid,(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-(4-chlorophenoxy)butanoate
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![(E)-but-2-enedioic acid,(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-(4-chlorophenoxy)butanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/0fcff4b7460649819755ae8b8d440fdc.png "(E)-but-2-enedioic acid,(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-(4-chlorophenoxy)butanoate")
(E)-but-2-enedioic acid,(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-(4-chlorophenoxy)butanoate
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CAS No:
155156-22-2
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Formula:
C22H28ClNO7
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Chemical Name:
(E)-but-2-enedioic acid,(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-(4-chlorophenoxy)butanoate
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Synonyms:
SM 21; Butanoic acid,2-(4-chlorophenoxy)-,8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester,(3(R)-endo)-,(Z)-2-butenedioate (1:1);
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CAS No:
Description
2-(4-chlorophenoxy)butanoic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester is a monocarboxylic acid.
(E)-but-2-enedioic acid,(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (2R)-2-(4-chlorophenoxy)butanoate Basic Attributes
453.91300
337.1444713
DTXSID60744276
Computed Properties
Molecular Weight:337.8
XLogP3:4.6
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:337.1444713
Monoisotopic Mass:337.1444713
Topological Polar Surface Area:38.8
Heavy Atom Count:23
Complexity:397
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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