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Product Overview

Product Code

CDN-D-7507

CAS Number

1310012-16-8

Product Format

Neat

Molecular Formula

2[C18 D7 H24 N O4] . C4 H4 O4

Molecular Weight

781.0445

Product Categories

Nitrogen compounds, Stable isotopes, Stable Isotope Labelled Analytical Standards, CDN

Product Type

Stable Isotope Labelled

Unlabelled CAS Number

104344-23-2

Purity

99 atom % D, min 98% Chemical Purity

Documentation

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Product Information

Analyte Data

Analyte Name

Bisoprolol-d7 Hemifumarate

CAS Number

1310012-16-8

Molecular Formula

2[C18 D7 H24 N O4] . C4 H4 O4

Molecular Weight

781.0445

Accurate Mass

780.5495

SMILES

[2H]C([2H])([2H])C([2H])(NCC(O)COc1ccc(COCCOC(C)C)cc1)C([2H])([2H])[2H].[2H]C([2H])([2H])C([2H])(NCC(O)COc2ccc(COCCOC(C)C)cc2)C([2H])([2H])[2H].OC(=O)\C=C\C(=O)O

InChI

InChI=1S/2C18H31NO4.C4H4O4/c2*1-14(2)19-11-17(20)13-23-18-7-5-16(6-8-18)12-21-9-10-22-15(3)4;5-3(6)1-2-4(7)8/h2*5-8,14-15,17,19-20H,9-13H2,1-4H3;1-2H,(H,5,6)(H,7,8)/b;;2-1+/i2*1D3,2D3,14D;

IUPAC

(E)-but-2-enedioic acid;1-(1,1,1,2,3,3,3-heptadeuteriopropan-2-ylamino)-3-[4-(2-propan-2-yloxyethoxymethyl)phenoxy]propan-2-ol

Unlabelled CAS Number

104344-23-2

SIL Type

Deuterium

Product Data

Storage Temperature

Room Temperature

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

Purity

99 atom % D, min 98% Chemical Purity

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Product Overview

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(±)-Bisoprolol-d7 Hemifumarate (iso-propyl-d7)

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