1-Piperazinecarboxylic acid, 3-oxo-, 1,1-dimethylethyl ester


Chemical Name: 1-Piperazinecarboxylic acid, 3-oxo-, 1,1-dimethylethyl ester
CAS Number: 76003-29-7
Product Number: AG003E1C(AGN-PC-0KPXSP)
Synonyms:
MDL No: MFCD02181069
Molecular Formula: C9H16N2O3
Molecular Weight: 200.2349

Identification/Properties


Properties
MP:
156-160 °C(lit.)
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
200.238g/mol
XLogP3:
0.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
200.116g/mol
Monoisotopic Mass:
200.116g/mol
Topological Polar Surface Area:
58.6A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
245
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#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


PNMR/1-Boc-3-oxopiperazine-76003-29-7-hnmr.pdf

Other Analytical Data


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