Name: Name:2,6-dimethyl 2-azabicyclo[2.2.2]oct-7-ene-2,6-dicarboxylate
Brand: Angene
SKU: AG01C3MC
Rating: 90 (10 reviews)

2,6-dimethyl 2-azabicyclo[2.2.2]oct-7-ene-2,6-dicarboxylate

CAS No.:

191937-34-5

Catalog Number:

AG01C3MC

Molecular Formula:

C11H15NO4

Molecular Weight:

225.2411

Catalog Number:

AG01C3MC

Chemical Name:

2,6-dimethyl 2-azabicyclo[2.2.2]oct-7-ene-2,6-dicarboxylate

CAS Number:

191937-34-5

Molecular Formula:

C11H15NO4

Molecular Weight:

225.2411

MDL Number:

MFCD00831338

IUPAC Name:

dimethyl 2-azabicyclo[2.2.2]oct-7-ene-2,6-dicarboxylate

InChI:

InChI=1S/C11H15NO4/c1-15-10(13)8-5-7-3-4-9(8)12(6-7)11(14)16-2/h3-4,7-9H,5-6H2,1-2H3

InChI Key:

VCNNKUIDIGDQQM-UHFFFAOYSA-N

SMILES:

COC(=O)C1CC2C=CC1N(C2)C(=O)OC

Complexity:

339

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

225.1g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

225.244g/mol

Monoisotopic Mass:

225.1g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.6