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16857-95-7

16857-95-7 | Piperidine, 1,1',1''-(1,3,5-benzenetriyl)tris-

CAS No: 16857-95-7 Catalog No: AG001Y5K MDL No:

Product Description

Catalog Number:
AG001Y5K
Chemical Name:
Piperidine, 1,1',1''-(1,3,5-benzenetriyl)tris-
CAS Number:
16857-95-7
Molecular Formula:
C21H33N3
Molecular Weight:
327.5068
IUPAC Name:
1-[3,5-di(piperidin-1-yl)phenyl]piperidine
InChI:
InChI=1S/C21H33N3/c1-4-10-22(11-5-1)19-16-20(23-12-6-2-7-13-23)18-21(17-19)24-14-8-3-9-15-24/h16-18H,1-15H2
InChI Key:
VYSPTRONAFCTMA-UHFFFAOYSA-N
SMILES:
C1CCN(CC1)c1cc(cc(c1)N1CCCCC1)N1CCCCC1

Properties

Complexity:
298  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.267g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
327.516g/mol
Monoisotopic Mass:
327.267g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
9.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8  

Literature

Title Journal
What is the preferred structure of the Meisenheimer-Wheland complex between sym-triaminobenzene and 4,6-dinitrobenzofuroxan? The Journal of organic chemistry 20100604
Evidence of reversibility in azo-coupling reactions between 1,3,5-tris(N,N-dialkylamino)benzenes and arenediazonium salts. The Journal of organic chemistry 20071109

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