Name: Name:2,5-Diazabicyclo[2.2.1]heptane-2-carboxylic acid, 7-hydroxy-, 1,1-dimethylethyl ester
Brand: Angene
SKU: AG0023J3
Rating: 90 (10 reviews)

2,5-Diazabicyclo[2.2.1]heptane-2-carboxylic acid, 7-hydroxy-, 1,1-dimethylethyl ester

CAS No.:

1822580-98-2

Catalog Number:

AG0023J3

Molecular Formula:

C10H18N2O3

Molecular Weight:

214.2615

Catalog Number:

AG0023J3

Chemical Name:

2,5-Diazabicyclo[2.2.1]heptane-2-carboxylic acid, 7-hydroxy-, 1,1-dimethylethyl ester

CAS Number:

1822580-98-2

Molecular Formula:

C10H18N2O3

Molecular Weight:

214.2615

MDL Number:

MFCD24533405

IUPAC Name:

tert-butyl 7-hydroxy-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate

InChI:

InChI=1S/C10H18N2O3/c1-10(2,3)15-9(14)12-5-6-8(13)7(12)4-11-6/h6-8,11,13H,4-5H2,1-3H3

InChI Key:

BETGJOXYTQTEPO-UHFFFAOYSA-N

SMILES:

OC1C2NCC1N(C2)C(=O)OC(C)(C)C

Complexity:

274

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

214.132g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

214.265g/mol

Monoisotopic Mass:

214.132g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

61.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.3