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861020-53-3 | 1-Benzyl-4-methylpiperazine Dihydrochloride
CAS No: 861020-53-3 Catalog No: AG003E04 MDL No:MFCD18711595
Product Description
Catalog Number:
AG003E04
Chemical Name:
1-Benzyl-4-methylpiperazine Dihydrochloride
CAS Number:
861020-53-3
Molecular Formula:
C12H20Cl2N2
Molecular Weight:
263.2066
MDL Number:
MFCD18711595
IUPAC Name:
1-benzyl-4-methylpiperazine;dihydrochloride
InChI:
InChI=1S/C12H18N2.2ClH/c1-13-7-9-14(10-8-13)11-12-5-3-2-4-6-12;;/h2-6H,7-11H2,1H3;2*1H
InChI Key:
VUYMPKDDLSQBDC-UHFFFAOYSA-N
SMILES:
CN1CCN(CC1)Cc1ccccc1.Cl.Cl
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.1g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
263.206g/mol
Monoisotopic Mass:
262.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
6.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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