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2-methylidene-1-azabicyclo[2.2.2]octan-3-one

2-methylidene-1-azabicyclo[2.2.2]octan-3-one structure

CAS No:
5291-26-9
Formula:
C8H11NO
Chemical Name:
2-methylidene-1-azabicyclo[2.2.2]octan-3-one
Synonyms:
2-methylenequinuclidin-3-one;5291-26-9;UNII-YBL6TAE47S;YBL6TAE47S;2-Methylene-3-quinuclidinone;2-methylidene-1-azabicyclo[2.2.2]octan-3-one;2-Methylenequinuclidin-3-one HCl;EINECS 227-413-0;2-Methylenequinuclidin-3-one hydrochloride;2-Methylene-3-quinuclidone;2-methylenequinuclidin3-one;Methylene quinuclidinone (mq);2-methylene-3-oxoquinuclidine;SCHEMBL1900903;ZINC155189;MFCD00204098;NSC 93806;MCULE-9846639440;2-methylene-1-aza-bicyclo[2.2.2]octan-3-one;1-Azabicyclo(2.2.2)octan-3-one, 2-methylene-
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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2-methylidene-1-azabicyclo[2.2.2]octan-3-one Basic Attributes

Molecular Weight：

137.18 g/mol

Exact Mass：

137.084063974 g/mol

UNII：

YBL6TAE47S

Characteristics

PSA：

20.3 Å²

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:137.18
XLogP3:1.2
Hydrogen Bond Acceptor Count:2
Exact Mass:137.084063974
Monoisotopic Mass:137.084063974
Topological Polar Surface Area:20.3
Heavy Atom Count:10
Complexity:189
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-methylidene-1-azabicyclo[2.2.2]octan-3-one

Basic Attributes
Characteristics
Safety Information
Computed Properties
Latest News
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