but-2-enedioic acid,(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(4-chlorophenoxy)butanoate
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![but-2-enedioic acid,(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(4-chlorophenoxy)butanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/1caf18a9b851408f906ed2e6197631f4.png "but-2-enedioic acid,(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(4-chlorophenoxy)butanoate")
but-2-enedioic acid,(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(4-chlorophenoxy)butanoate
structure -
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CAS No:
155058-71-2
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Formula:
C22H28ClNO7
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Chemical Name:
but-2-enedioic acid,(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(4-chlorophenoxy)butanoate
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Synonyms:
SM-21 maleate; HMS3266P19;
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CAS No:
but-2-enedioic acid,(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(4-chlorophenoxy)butanoate Basic Attributes
453.91300
453.1554299
DTXSID60744276
Safety Information
R36/37/38
S26
Xi
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:453.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:8
Exact Mass:453.1554299
Monoisotopic Mass:453.1554299
Topological Polar Surface Area:113
Heavy Atom Count:31
Complexity:516
Undefined Atom Stereocenter Count:3
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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