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1799421-11-6 | 1,2-Ethanediamine, N1-(3-chloro-2-piperazinyl)-, hydrochloride (1:1)
CAS No: 1799421-11-6 Catalog No: AG0021HM MDL No:
Product Description
Catalog Number:
AG0021HM
Chemical Name:
1,2-Ethanediamine, N1-(3-chloro-2-piperazinyl)-, hydrochloride (1:1)
CAS Number:
1799421-11-6
Molecular Formula:
C6H16Cl2N4
Molecular Weight:
215.1240
IUPAC Name:
N'-(3-chloropiperazin-2-yl)ethane-1,2-diamine;hydrochloride
InChI:
InChI=1S/C6H15ClN4.ClH/c7-5-6(10-2-1-8)11-4-3-9-5;/h5-6,9-11H,1-4,8H2;1H
InChI Key:
APYZFJKLAWJQLP-UHFFFAOYSA-N
SMILES:
NCCNC1NCCNC1Cl.Cl
Properties
Complexity:
111
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.075g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
215.122g/mol
Monoisotopic Mass:
214.075g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
62.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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