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101620-78-4 | 1-Piperidinebutanamine, 4-(diphenylmethoxy)-
CAS No: 101620-78-4 Catalog No: AG0004ZB MDL No:
Product Description
Catalog Number:
AG0004ZB
Chemical Name:
1-Piperidinebutanamine, 4-(diphenylmethoxy)-
CAS Number:
101620-78-4
Molecular Formula:
C22H30N2O
Molecular Weight:
338.4864
IUPAC Name:
4-(4-benzhydryloxypiperidin-1-yl)butan-1-amine
InChI:
InChI=1S/C22H30N2O/c23-15-7-8-16-24-17-13-21(14-18-24)25-22(19-9-3-1-4-10-19)20-11-5-2-6-12-20/h1-6,9-12,21-22H,7-8,13-18,23H2
InChI Key:
BTHADVCATBNKSE-UHFFFAOYSA-N
SMILES:
NCCCCN1CCC(CC1)OC(c1ccccc1)c1ccccc1
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.236g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
338.495g/mol
Monoisotopic Mass:
338.236g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
38.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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