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6968-76-9 | 1-(3-Methoxyphenyl)piperazine dihydrochloride
CAS No: 6968-76-9 Catalog No: AG003CXG MDL No:MFCD00035285
Product Description
Catalog Number:
AG003CXG
Chemical Name:
1-(3-Methoxyphenyl)piperazine dihydrochloride
CAS Number:
6968-76-9
Molecular Formula:
C11H18Cl2N2O
Molecular Weight:
265.1794
MDL Number:
MFCD00035285
IUPAC Name:
1-(3-methoxyphenyl)piperazine;dihydrochloride
InChI:
InChI=1S/C11H16N2O.2ClH/c1-14-11-4-2-3-10(9-11)13-7-5-12-6-8-13;;/h2-4,9,12H,5-8H2,1H3;2*1H
InChI Key:
UKUNKQNESKRETR-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)N1CCNCC1.Cl.Cl
EC Number:
230-189-7
UNII:
Q0T82QHG7N
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.08g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
265.178g/mol
Monoisotopic Mass:
264.08g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
24.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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