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23145-92-8 | Piperazine, 1-[(3-chlorophenyl)methyl]-, hydrochloride (1:2)
CAS No: 23145-92-8 Catalog No: AG002MCF MDL No:
Product Description
Catalog Number:
AG002MCF
Chemical Name:
Piperazine, 1-[(3-chlorophenyl)methyl]-, hydrochloride (1:2)
CAS Number:
23145-92-8
Molecular Formula:
C11H17Cl3N2
Molecular Weight:
283.6251
IUPAC Name:
1-[(3-chlorophenyl)methyl]piperazine;dihydrochloride
InChI:
InChI=1S/C11H15ClN2.2ClH/c12-11-3-1-2-10(8-11)9-14-6-4-13-5-7-14;;/h1-3,8,13H,4-7,9H2;2*1H
InChI Key:
QIDRCPGKNNJVJM-UHFFFAOYSA-N
SMILES:
Clc1cccc(c1)CN1CCNCC1.Cl.Cl
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.046g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
283.621g/mol
Monoisotopic Mass:
282.046g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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