Hexamidine-d12 Dihydrochloride

Analyte Name

Hexamidine-d12 Dihydrochloride

CAS Number

1286461-12-8

Molecular Formula

C20 D12 H14 N4 O2

Molecular Weight

366.52

Accurate Mass

366.281

SMILES

[2H]C([2H])(Oc1ccc(cc1)C(=N)N)C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])Oc2ccc(cc2)C(=N)N

InChI

InChI=1S/C20H26N4O2/c21-19(22)15-5-9-17(10-6-15)25-13-3-1-2-4-14-26-18-11-7-16(8-12-18)20(23)24/h5-12H,1-4,13-14H2,(H3,21,22)(H3,23,24)/i1D2,2D2,3D2,4D2,13D2,14D2

IUPAC

4-[6-(4-carbamimidoylphenoxy)-1,1,2,2,3,3,4,4,5,5,6,6-dodecadeuteriohexoxy]benzenecarboximidamide

Unlabelled CAS Number

50357-46-5

SIL Type

Deuterium

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

Purity

>95% (HPLC)