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Structure

2-(1,3-Benzodioxol-5-ylmethylidene)-1-azabicyclo[2.2.2]octan-3-one

CAS
111896-94-7
Catalog Number
ACM111896947
Category
Other Products
Molecular Weight
257.284 g/mol
Molecular Formula
C15H15NO3

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Specification

Synonyms
BRN 5754431, 2-(3,4-Methylenedioxyphenylmethylene)-3-oxoquinuclidine, 2-(1,3-Benzodioxol-5-ylmethylene)-1-azabicyclo(2.2.2)octan-3-one, 1-AZABICYCLO(2.2.2)OCTAN-3-ONE, 2-(1,3-BENZODIOXOL-5-YLMETHYLENE)-, AC1L1TEH, Maybridge1_003469, MCULE-9462413832, LS-22629, 2-(1,3-benzodioxol-5-ylmethylidene)quinuclidin-3-one, 2-[(Z)-1,3-benzodioxol-5-ylmethylidene]-3-quinuclidinone, 2-(1,3-benzodioxol-5-ylmethylidene)-1-azabicyclo[2.2.2]octan-3-one, 111896-94-7
IUPAC Name
2-(1,3-benzodioxol-5-ylmethylidene)-1-azabicyclo[2.2.2]octan-3-one
Canonical SMILES
C1CN2CCC1C(=O)C2=CC3=CC4=C(C=C3)OCO4
InChI Key
NGNUATHUAAONSD-UHFFFAOYSA-N
Boiling Point
453ºC at 760mmHg
Flash Point
227.8ºC
Density
1.35g/cm³
Exact Mass
257.10500
H-Bond Acceptor
4
H-Bond Donor
0
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