Home Carboxys Tert-Butyl 4-[4-(3,3-Dimethylbutyl)Anilino]-1-Piperidinecarboxylate

Tert-Butyl 4-[4-(3,3-Dimethylbutyl)Anilino]-1-Piperidinecarboxylate

CAS No.:
241499-53-6
Catalog Number:
AG01DFS9
Molecular Formula:
C22H36N2O2
Molecular Weight:
360.5334
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Product Description
Catalog Number:
AG01DFS9
Chemical Name:
Tert-Butyl 4-[4-(3,3-Dimethylbutyl)Anilino]-1-Piperidinecarboxylate
CAS Number:
241499-53-6
Molecular Formula:
C22H36N2O2
Molecular Weight:
360.5334
MDL Number:
MFCD12974686
IUPAC Name:
tert-butyl 4-[4-(3,3-dimethylbutyl)anilino]piperidine-1-carboxylate
InChI:
InChI=1S/C22H36N2O2/c1-21(2,3)14-11-17-7-9-18(10-8-17)23-19-12-15-24(16-13-19)20(25)26-22(4,5)6/h7-10,19,23H,11-16H2,1-6H3
InChI Key:
JHBPVQAJAHQMRV-UHFFFAOYSA-N
SMILES:
O=C(N1CCC(CC1)Nc1ccc(cc1)CCC(C)(C)C)OC(C)(C)C
Properties
Complexity:
434  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
360.278g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
360.542g/mol
Monoisotopic Mass:
360.278g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9  
Properties