Name: Name:9-Hydroxy-3,7-diaza-bicyclo[3.3.1]nonane-3-carboxylic acid tert-butyl ester
Brand: Angene
SKU: AG00CKZE
Rating: 90 (10 reviews)

9-Hydroxy-3,7-diaza-bicyclo[3.3.1]nonane-3-carboxylic acid tert-butyl ester

CAS No.:

313238-53-8

Catalog Number:

AG00CKZE

Molecular Formula:

C12H22N2O3

Molecular Weight:

242.3147

Catalog Number:

AG00CKZE

Chemical Name:

9-Hydroxy-3,7-diaza-bicyclo[3.3.1]nonane-3-carboxylic acid tert-butyl ester

CAS Number:

313238-53-8

Molecular Formula:

C12H22N2O3

Molecular Weight:

242.3147

MDL Number:

MFCD24532916

IUPAC Name:

tert-butyl 9-hydroxy-3,7-diazabicyclo[3.3.1]nonane-3-carboxylate

InChI:

InChI=1S/C12H22N2O3/c1-12(2,3)17-11(16)14-6-8-4-13-5-9(7-14)10(8)15/h8-10,13,15H,4-7H2,1-3H3

InChI Key:

NXIZCOXUZZYOOJ-UHFFFAOYSA-N

SMILES:

OC1C2CNCC1CN(C2)C(=O)OC(C)(C)C

Complexity:

287

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

242.163g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

242.319g/mol

Monoisotopic Mass:

242.163g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

61.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.1