Name: Name:2-Azabicyclo[2.2.1]hept-5-ene-2-carboxylic acid, 3-oxo-, 1,1-diMethylethyl ester
Brand: Angene
SKU: AG00ABH6
Rating: 90 (10 reviews)

2-Azabicyclo[2.2.1]hept-5-ene-2-carboxylic acid, 3-oxo-, 1,1-diMethylethyl ester

CAS No.:

162427-15-8

Catalog Number:

AG00ABH6

Molecular Formula:

C11H15NO3

Molecular Weight:

209.2417

Catalog Number:

AG00ABH6

Chemical Name:

2-Azabicyclo[2.2.1]hept-5-ene-2-carboxylic acid, 3-oxo-, 1,1-diMethylethyl ester

CAS Number:

162427-15-8

Molecular Formula:

C11H15NO3

Molecular Weight:

209.2417

MDL Number:

MFCD17679262

IUPAC Name:

tert-butyl 3-oxo-2-azabicyclo[2.2.1]hept-5-ene-2-carboxylate

InChI:

InChI=1S/C11H15NO3/c1-11(2,3)15-10(14)12-8-5-4-7(6-8)9(12)13/h4-5,7-8H,6H2,1-3H3

InChI Key:

NQIZWJGHIYDHRL-UHFFFAOYSA-N

SMILES:

O=C(N1C2C=CC(C1=O)C2)OC(C)(C)C

Complexity:

340

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

209.105g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

209.245g/mol

Monoisotopic Mass:

209.105g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.4