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Home > Bromides > 1417793-67-9
1417793-67-9 | Pyridine, 5-bromo-2-(4-piperidinylmethoxy)-, hydrochloride (1:1)
CAS No: 1417793-67-9 Catalog No: AG001H3O MDL No:
Product Description
Catalog Number:
AG001H3O
Chemical Name:
Pyridine, 5-bromo-2-(4-piperidinylmethoxy)-, hydrochloride (1:1)
CAS Number:
1417793-67-9
Molecular Formula:
C11H16BrClN2O
Molecular Weight:
307.6145
IUPAC Name:
5-bromo-2-(piperidin-4-ylmethoxy)pyridine;hydrochloride
InChI:
InChI=1S/C11H15BrN2O.ClH/c12-10-1-2-11(14-7-10)15-8-9-3-5-13-6-4-9;/h1-2,7,9,13H,3-6,8H2;1H
InChI Key:
VHZOAVYVFAFIAA-UHFFFAOYSA-N
SMILES:
Brc1ccc(nc1)OCC1CCNCC1.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:
306.013g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
307.616g/mol
Monoisotopic Mass:
306.013g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
34.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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