Name: Name:3,7-dioxa-9-azabicyclo[3.3.1]nonane
Brand: Angene
SKU: AG01A2ZE
Rating: 90 (10 reviews)

3,7-dioxa-9-azabicyclo[3.3.1]nonane

CAS No.:

873336-52-8

Catalog Number:

AG01A2ZE

Molecular Formula:

C6H11NO2

Molecular Weight:

129.1570

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Product Description

Catalog Number:

AG01A2ZE

Chemical Name:

3,7-dioxa-9-azabicyclo[3.3.1]nonane

CAS Number:

873336-52-8

Molecular Formula:

C6H11NO2

Molecular Weight:

129.1570

IUPAC Name:

3,7-dioxa-9-azabicyclo[3.3.1]nonane

InChI:

InChI=1S/C6H11NO2/c1-5-2-9-4-6(7-5)3-8-1/h5-7H,1-4H2

InChI Key:

NHUACECKDDIIEA-UHFFFAOYSA-N

SMILES:

O1CC2COCC(C1)N2

Properties

Complexity:

87.2

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

129.079g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

129.159g/mol

Monoisotopic Mass:

129.079g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

30.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.8

Literature

Title	Journal
Concise synthesis of 3,7-dioxa-9-aza-bicyclo[3,3,1]-nonane.	The Journal of organic chemistry 20060106