CAS 10045-25-7 1,4,7,10-Tetraazacyclododecane tetrahydrochloride

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1,4,7,10-Tetraazacyclododecane tetrahydrochloride

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Catalog Number

ACM10045257-1

CAS Number

10045-25-7

Product Name

1,4,7,10-Tetraazacyclododecane tetrahydrochloride

Structure

Category

Macrocycles; Supramolecular Host Materials

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

Purity

98%

Appearance

White crystalline solid

Complexity

65.1

Covalently-Bonded Unit Count

EC Number

600-097-5

Exact Mass

318.072557

Heavy Atom Count

Hydrogen Bond Acceptor Count

Hydrogen Bond Donor Count

Monoisotopic Mass

316.075508

Rotatable Bond Count

Topological Polar Surface Area

48.1 Å²

UNII

51830Y7TIX

MSDS

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COA

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Spec Sheet

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