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1417794-58-1

1417794-58-1 | 4-Piperidinemethanamine, 1-(5-bromo-2-pyridinyl)-, hydrochloride (1:1)

CAS No: 1417794-58-1 Catalog No: AG001H5S MDL No:

Product Description

Catalog Number:
AG001H5S
Chemical Name:
4-Piperidinemethanamine, 1-(5-bromo-2-pyridinyl)-, hydrochloride (1:1)
CAS Number:
1417794-58-1
Molecular Formula:
C11H17BrClN3
Molecular Weight:
306.6298
IUPAC Name:
[1-(5-bromopyridin-2-yl)piperidin-4-yl]methanamine;hydrochloride
InChI:
InChI=1S/C11H16BrN3.ClH/c12-10-1-2-11(14-8-10)15-5-3-9(7-13)4-6-15;/h1-2,8-9H,3-7,13H2;1H
InChI Key:
AUGPYLPBSCLWHV-UHFFFAOYSA-N
SMILES:
NCC1CCN(CC1)c1ccc(cn1)Br.Cl

Properties

Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.029g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
306.632g/mol
Monoisotopic Mass:
305.029g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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