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

Catalog Number

ACM111896947

Product Name

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

CAS

111896-94-7

Category

Heterocyclic Organic Compound

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

Molecular Weight

257.284 g/mol

Molecular Formula

C₁₅H₁₅NO₃

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

MSDS

COA

Spec Sheet