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1289387-58-1

1289387-58-1 | 2-Piperidinemethanamine, N-[(4-methylphenyl)methyl]-, hydrochloride (1:1)

CAS No: 1289387-58-1 Catalog No: AG000YNK MDL No:

Product Description

Catalog Number:
AG000YNK
Chemical Name:
2-Piperidinemethanamine, N-[(4-methylphenyl)methyl]-, hydrochloride (1:1)
CAS Number:
1289387-58-1
Molecular Formula:
C14H23ClN2
Molecular Weight:
254.7988
IUPAC Name:
N-[(4-methylphenyl)methyl]-1-piperidin-2-ylmethanamine;hydrochloride
InChI:
InChI=1S/C14H22N2.ClH/c1-12-5-7-13(8-6-12)10-15-11-14-4-2-3-9-16-14;/h5-8,14-16H,2-4,9-11H2,1H3;1H
InChI Key:
TZBXXIAZMAGLDF-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)CNCC1CCCCN1.Cl

Properties

Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.155g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
254.802g/mol
Monoisotopic Mass:
254.155g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
24.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0

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