Name: Name:tert-butyl (1S,4S,5R)-rel-5-amino-2-azabicyclo[2.2.1]heptane-2-carboxylate
Brand: Angene
SKU: AG00IKUY
Rating: 90 (10 reviews)

tert-butyl (1S,4S,5R)-rel-5-amino-2-azabicyclo[2.2.1]heptane-2-carboxylate

CAS No.:

1290539-90-0

Catalog Number:

AG00IKUY

Molecular Formula:

C11H20N2O2

Molecular Weight:

212.2887

Catalog Number:

AG00IKUY

Chemical Name:

tert-butyl (1S,4S,5R)-rel-5-amino-2-azabicyclo[2.2.1]heptane-2-carboxylate

CAS Number:

1290539-90-0

Molecular Formula:

C11H20N2O2

Molecular Weight:

212.2887

IUPAC Name:

tert-butyl (1R,4R,5S)-5-amino-2-azabicyclo[2.2.1]heptane-2-carboxylate

InChI:

InChI=1S/C11H20N2O2/c1-11(2,3)15-10(14)13-6-7-4-8(13)5-9(7)12/h7-9H,4-6,12H2,1-3H3/t7-,8-,9+/m1/s1

InChI Key:

HGLKMYOTFGKEDG-HLTSFMKQSA-N

SMILES:

N[C@@H]1C[C@@H]2C[C@H]1CN2C(=O)OC(C)(C)C

Complexity:

272

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

212.152g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

212.293g/mol

Monoisotopic Mass:

212.152g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8