IUPAC Name: | N'-(2-piperazin-1-ylethyl)ethane-1,2-diamine |
Description: | A hydrochloride form of N1-[2-(1-Piperazinyl)ethyl]-1,2-ethanediamine (P481230), an impurity of Diethylenetriamine (D444255); a compound that is used in biological studies for polyamines inhibition to carbonic anhydrases by anchoring to the zinc-coordinated water molecule. |
Molecular Weight: | 172.27 + x(36.46) |
Molecular Formula: | C8H20N4·x(HCl) |
Canonical SMILES: | C1CN(CCN1)CCNCCN |
InChI: | InChI=1S/C8H20N4/c9-1-2-10-3-6-12-7-4-11-5-8-12/h10-11H,1-9H2 |
InChI Key: | WBIWIXJUBVWKLS-UHFFFAOYSA-N |
Melting Point: | 77-79°C |
Solubility: | DMSO (Slightly, Heated), Water (Slightly) |
Appearance: | Off-White Solid |
Storage: | Hygroscopic, Refrigerator, under inert atmosphere |
References: | Carta, F., et al. J. Med. Chem., 53, 5511(2010). |
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