1,4,7,10-Tetraazacyclododecane tetrahydrochloride

• Catalog Number: ACM10045257-1
• Product Name: 1,4,7,10-Tetraazacyclododecane tetrahydrochloride
• CAS: 10045-25-7
• Category: Heterocyclic Organic Compound
• Synonyms: Cyclen tetrahydrochloride; Tetraaza-12-crown-4 tetrahydrochloride
• IUPAC Name: 1,4,7,10-tetrazacyclododecane;tetrahydrochloride
• Molecular Weight: 318.12
• Molecular Formula: C8H24Cl4N4
• Canonical SMILES: C1CNCCNCCNCCN1.Cl.Cl.Cl.Cl
• InChI: SBWLCGZEBQGYRP-UHFFFAOYSA-N
• InChI Key: InChI=1S/C8H20N4.4ClH/c1-2-10-5-6-12-8-7-11-4-3-9-1;;;;/h9-12H,1-8H2;4*1H
• Melting Point: 297-300 °C
• Appearance: White crystalline solid
• Complexity: 65.1
• Covalently-Bonded Unit Count: 5
• EC Number: 600-097-5
• Exact Mass: 318.072557
• H-Bond Acceptor: 4
• H-Bond Donor: 8
• Heavy Atom Count: 16
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 8
• Monoisotopic Mass: 316.075508
• Rotatable Bond Count: 0
• Topological Polar Surface Area: 48.1 Ų
• UNII: 51830Y7TIX