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126055-32-1 | Piperazine, 1-(2-chloroethyl)-4-methyl-, hydrochloride (1:1)
CAS No: 126055-32-1 Catalog No: AG000QV1 MDL No:MFCD12031872
Product Description
Catalog Number:
AG000QV1
Chemical Name:
Piperazine, 1-(2-chloroethyl)-4-methyl-, hydrochloride (1:1)
CAS Number:
126055-32-1
Molecular Formula:
C7H16Cl2N2
Molecular Weight:
199.1213
MDL Number:
MFCD12031872
IUPAC Name:
1-(2-chloroethyl)-4-methylpiperazine;hydrochloride
InChI:
InChI=1S/C7H15ClN2.ClH/c1-9-4-6-10(3-2-8)7-5-9;/h2-7H2,1H3;1H
InChI Key:
NVYZDOQALWYSEJ-UHFFFAOYSA-N
SMILES:
ClCCN1CCN(CC1)C.Cl
Properties
Complexity:
89.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.069g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
199.119g/mol
Monoisotopic Mass:
198.069g/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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