tert-butyl 4-[(4-nitrophenyl)methyl]piperazine-1-carboxylate


Chemical Name: tert-butyl 4-[(4-nitrophenyl)methyl]piperazine-1-carboxylate
CAS Number: 130636-61-2
Product Number: AG000UQL(AGN-PC-044C4N)
Synonyms:
MDL No:
Molecular Formula: C16H23N3O4
Molecular Weight: 321.3715

Identification/Properties


Computed Properties
Molecular Weight:
321.377g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
321.169g/mol
Monoisotopic Mass:
321.169g/mol
Topological Polar Surface Area:
78.6A^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:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback