tert-butyl (3R)-3-cyanopiperazine-1-carboxylate


Chemical Name: tert-butyl (3R)-3-cyanopiperazine-1-carboxylate
CAS Number: 859518-35-7
Product Number: AG003LT9(AGN-PC-059B2W)
Synonyms:
MDL No: MFCD09991479
Molecular Formula: C10H17N3O2
Molecular Weight: 211.2609

Identification/Properties


Properties
BP:
322.9°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
211.265g/mol
XLogP3:
0.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
211.132g/mol
Monoisotopic Mass:
211.132g/mol
Topological Polar Surface Area:
65.4A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
287
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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