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Product Overview

Product Code

TRC-M264752

CAS Number

922730-95-8

Product Format

Neat

Molecular Formula

C7H5D3N2O3

Molecular Weight

171.17

Unlabelled CAS Number

96-96-8

Product Information

Analyte Name

4-(Methoxy-d3)-2-nitroaniline

CAS Number

922730-95-8

Molecular Formula

C7H5D3N2O3

Molecular Weight

171.17

Accurate Mass

171.0723

SMILES

[2H]C([2H])([2H])Oc1ccc(N)c(c1)[N+](=O)[O-]

InChI

InChI=1S/C7H8N2O3/c1-12-5-2-3-6(8)7(4-5)9(10)11/h2-4H,8H2,1H3/i1D3

IUPAC

2-nitro-4-(trideuteriomethoxy)aniline

Unlabelled CAS Number

96-96-8

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled; API; Contaminant

Product Format

Neat

Labelled 4-Methoxy-2-nitroaniline is used in the preparation of isotopically substituted benzimidazoles as proton pump inhibitors.

References: Arne, B., et al.: Acta Chemica Scandinavica, 43, 595

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