tert-butyl 3-nitropyrrolidine-1-carboxylate


Chemical Name: tert-butyl 3-nitropyrrolidine-1-carboxylate
CAS Number: 1309581-43-8
Product Number: AG000V68(AGN-PC-0BLDNY)
Synonyms:
MDL No:
Molecular Formula: C9H16N2O4
Molecular Weight: 216.2343

Identification/Properties


Computed Properties
Molecular Weight:
216.237g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
216.111g/mol
Monoisotopic Mass:
216.111g/mol
Topological Polar Surface Area:
75.4A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
266
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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