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Home > Pyridines > 333992-80-6
333992-80-6 | 1-Pyridin-4-ylmethyl-piperazine trihydrochloride
CAS No: 333992-80-6 Catalog No: AG01FM0C MDL No:MFCD11519392
Product Description
Catalog Number:
AG01FM0C
Chemical Name:
1-Pyridin-4-ylmethyl-piperazine trihydrochloride
CAS Number:
333992-80-6
Molecular Formula:
C10H18Cl3N3
Molecular Weight:
286.6290
MDL Number:
MFCD11519392
IUPAC Name:
1-(pyridin-4-ylmethyl)piperazine;trihydrochloride
InChI:
InChI=1S/C10H15N3.3ClH/c1-3-11-4-2-10(1)9-13-7-5-12-6-8-13;;;/h1-4,12H,5-9H2;3*1H
InChI Key:
UYVUULVUAOCZLR-UHFFFAOYSA-N
SMILES:
N1CCN(CC1)Cc1ccncc1.Cl.Cl.Cl
Properties
Complexity:
137
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
4
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.057g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
286.625g/mol
Monoisotopic Mass:
285.057g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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