1,4,7,10,13,16-Hexaazacyclooctadecane

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Catalog Number

ACM296355

Product Name

Structure

CAS

296-35-5

Category

Heterocyclic Organic Compound

Synonyms

AMOT0368; FT-0655479; IPS109; TR-012845; Hexacyclen; MCULE-4374893659; 296-35-5; AM85706; ACMC-1CS19; CTK1A4125;

IUPAC Name

1,4,7,10,13,16-hexazacyclooctadecane;

Molecular Weight

258.414g/mol

Molecular Formula

C12H30N6;

Canonical SMILES

C1CNCCNCCNCCNCCNCCN1;

InChI

InChI=1S/C12H30N6/c1-2-14-5-6-16-9-10-18-12-11-17-8-7-15-4-3-13-1/h13-18H,1-12H2;

InChI Key

RVJABZUDCPZPPM-UHFFFAOYSA-N;

Complexity

108

Covalently-Bonded Unit Count

EC Number

206-042-8

Exact Mass

258.253g/mol

H-Bond Acceptor

H-Bond Donor

Heavy Atom Count

Monoisotopic Mass

258.253g/mol

Topological Polar Surface Area

72.2A^2

MSDS

COA

Spec Sheet

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