Product Code

TRC-B285732

CAS Number

1246814-48-1

Product Format

Neat

Molecular Formula

C29H27D4F2NO4

Molecular Weight

499.58

Product Categories

TRC, Stable isotopes, Pharmaceutical Toxicology Reference Materials , API Reference Standards & Research Materials

Product Type

Stable Isotope Labelled, Bioactive Small Molecule

Unlabelled CAS Number

929706-85-4

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

rac N-Benzyl Nebivolol-d4

CAS Number

1246814-48-1

Molecular Formula

C29H27D4F2NO4

Molecular Weight

499.58

Accurate Mass

499.2472

SMILES

[2H]C([2H])(C(O)C1CCc2cc(F)ccc2O1)N(Cc3ccccc3)C([2H])([2H])C(O)C4CCc5cc(F)ccc5O4

InChI

InChI=1S/C29H31F2NO4/c30-22-8-12-26-20(14-22)6-10-28(35-26)24(33)17-32(16-19-4-2-1-3-5-19)18-25(34)29-11-7-21-15-23(31)9-13-27(21)36-29/h1-5,8-9,12-15,24-25,28-29,33-34H,6-7,10-11,16-18H2/i17D2,18D2

IUPAC

2-[benzyl-[1,1-dideuterio-2-(6-fluoro-3,4-dihydro-2H-chromen-2-yl)-2-hydroxyethyl]amino]-2,2-dideuterio-1-(6-fluoro-3,4-dihydro-2H-chromen-2-yl)ethanol

Unlabelled CAS Number

929706-85-4

SIL Type

Deuterium

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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rac N-Benzyl Nebivolol-d4

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