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Home > Pyridines > 1158392-64-3
1158392-64-3 | Piperazine, 1-(3-pyridinylmethyl)-, hydrochloride (1:2)
CAS No: 1158392-64-3 Catalog No: AG000GXY MDL No:MFCD08544422
Product Description
Catalog Number:
AG000GXY
Chemical Name:
Piperazine, 1-(3-pyridinylmethyl)-, hydrochloride (1:2)
CAS Number:
1158392-64-3
Molecular Formula:
C10H17Cl2N3
Molecular Weight:
250.1681
MDL Number:
MFCD08544422
IUPAC Name:
1-(pyridin-3-ylmethyl)piperazine;dihydrochloride
InChI:
InChI=1S/C10H15N3.2ClH/c1-2-10(8-12-3-1)9-13-6-4-11-5-7-13;;/h1-3,8,11H,4-7,9H2;2*1H
InChI Key:
BHKUPXAMBZATPA-UHFFFAOYSA-N
SMILES:
N1CCN(CC1)Cc1cccnc1.Cl.Cl
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.08g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
250.167g/mol
Monoisotopic Mass:
249.08g/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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