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1289386-47-5 | 4-Piperidinemethanamine, N,N-bis[(2-methylphenyl)methyl]-, hydrochloride (1:1)
CAS No: 1289386-47-5 Catalog No: AG000YM3 MDL No:
Product Description
Catalog Number:
AG000YM3
Chemical Name:
4-Piperidinemethanamine, N,N-bis[(2-methylphenyl)methyl]-, hydrochloride (1:1)
CAS Number:
1289386-47-5
Molecular Formula:
C22H31ClN2
Molecular Weight:
358.9479
IUPAC Name:
N,N-bis[(2-methylphenyl)methyl]-1-piperidin-4-ylmethanamine;hydrochloride
InChI:
InChI=1S/C22H30N2.ClH/c1-18-7-3-5-9-21(18)16-24(15-20-11-13-23-14-12-20)17-22-10-6-4-8-19(22)2;/h3-10,20,23H,11-17H2,1-2H3;1H
InChI Key:
KKKIARXLZYSSOZ-UHFFFAOYSA-N
SMILES:
Cc1ccccc1CN(Cc1ccccc1C)CC1CCNCC1.Cl
Properties
Complexity:
326
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
358.218g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
358.954g/mol
Monoisotopic Mass:
358.218g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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