Product Code

TRC-A637357

Product Format

Neat

Molecular Formula

C17 D12 H9 N3 O4

Molecular Weight

343.44

Product Categories

TRC, Stable isotopes

Product Type

Stable Isotope Labelled

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

Anastrozole Diacid-d12

Molecular Formula

C17 D12 H9 N3 O4

Molecular Weight

343.44

Accurate Mass

343.229

SMILES

[2H]C([2H])([2H])C(C(=O)O)(c1cc(Cn2cncn2)cc(c1)C(C(=O)O)(C([2H])([2H])[2H])C([2H])([2H])[2H])C([2H])([2H])[2H]

InChI

InChI=1S/C17H21N3O4/c1-16(2,14(21)22)12-5-11(8-20-10-18-9-19-20)6-13(7-12)17(3,4)15(23)24/h5-7,9-10H,8H2,1-4H3,(H,21,22)(H,23,24)/i1D3,2D3,3D3,4D3

IUPAC

2-[3-(2-carboxy-1,1,1,3,3,3-hexadeuteriopropan-2-yl)-5-(1,2,4-triazol-1-ylmethyl)phenyl]-3,3,3-trideuterio-2-(trideuteriomethyl)propanoic acid

SIL Type

Deuterium

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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Anastrozole Diacid-d12

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