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116269-53-5 | 1,4'-Bipiperidine, 1'-(phenylmethyl)-
CAS No: 116269-53-5 Catalog No: AG000C2T MDL No:
Product Description
Catalog Number:
AG000C2T
Chemical Name:
1,4'-Bipiperidine, 1'-(phenylmethyl)-
CAS Number:
116269-53-5
Molecular Formula:
C17H26N2
Molecular Weight:
258.4017
IUPAC Name:
1-benzyl-4-piperidin-1-ylpiperidine
InChI:
InChI=1S/C17H26N2/c1-3-7-16(8-4-1)15-18-13-9-17(10-14-18)19-11-5-2-6-12-19/h1,3-4,7-8,17H,2,5-6,9-15H2
InChI Key:
NTYOWZTVTNNSJW-UHFFFAOYSA-N
SMILES:
C1CCN(CC1)C1CCN(CC1)Cc1ccccc1
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.21g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.409g/mol
Monoisotopic Mass:
258.21g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
6.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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