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1177353-50-2 | 8-(piperazin-1-yl)quinoline dihydrochloride
CAS No: 1177353-50-2 Catalog No: AG00JW7D MDL No:MFCD08277618
Product Description
Catalog Number:
AG00JW7D
Chemical Name:
8-(piperazin-1-yl)quinoline dihydrochloride
CAS Number:
1177353-50-2
Molecular Formula:
C13H17Cl2N3
Molecular Weight:
286.2002
MDL Number:
MFCD08277618
IUPAC Name:
8-piperazin-1-ylquinoline;dihydrochloride
InChI:
InChI=1S/C13H15N3.2ClH/c1-3-11-4-2-6-15-13(11)12(5-1)16-9-7-14-8-10-16;;/h1-6,14H,7-10H2;2*1H
InChI Key:
NFEHTPJZZGLOTG-UHFFFAOYSA-N
SMILES:
N1CCN(CC1)c1cccc2c1nccc2.Cl.Cl
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.08g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
286.2g/mol
Monoisotopic Mass:
285.08g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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