tert-butyl 4-(4-nitroanilino)piperidine-1-carboxylate


Chemical Name: tert-butyl 4-(4-nitroanilino)piperidine-1-carboxylate
CAS Number: 333986-61-1
Product Number: AG00CK4E(AGN-PC-03JBO5)
Synonyms:
MDL No:
Molecular Formula: C16H23N3O4
Molecular Weight: 321.3715

Identification/Properties


Computed Properties
Molecular Weight:
321.377g/mol
XLogP3:
3.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
321.169g/mol
Monoisotopic Mass:
321.169g/mol
Topological Polar Surface Area:
87.4A^2
Heavy Atom Count:
23
Formal Charge:
0
Complexity:
414
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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