2,5-Diazabicyclo[2.2.1]heptane-2-carboxylic acid, 1,1-dimethylethylester, (1R,4R)-


Chemical Name: 2,5-Diazabicyclo[2.2.1]heptane-2-carboxylic acid, 1,1-dimethylethylester, (1R,4R)-
CAS Number: 134003-84-2
Product Number: AG0037UF(AGN-PC-0PK5TX)
Synonyms:
MDL No:
Molecular Formula: C10H18N2O2
Molecular Weight: 198.2621

Identification/Properties


Computed Properties
Molecular Weight:
198.266g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
198.137g/mol
Monoisotopic Mass:
198.137g/mol
Topological Polar Surface Area:
41.6A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
247
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


PNMR/1R4R-TERT-BUTYL_25-DIAZABICYCLO-134003-84-2-hnmr.pdf

Other Analytical Data


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