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Product Overview

Product Code

TRC-T535252

CAS Number

1246816-93-2

Product Format

Neat

Molecular Formula

C14H7D4NO5

Molecular Weight

277.27

API Family

Tolcapone

Product Categories

TRC, Enzyme inhibitors, Enzyme inhibitors, API Reference Standards & Research Materials, Catechol O-Methyltransferase, Parkinson's, Stable isotopes, Stable Isotope Labelled Analytical Standards, Pharmaceutical Toxicology Reference Materials

Product Type

Stable Isotope Labelled, API

Unlabelled CAS Number

134308-13-7

Documentation

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Product Information

Chemical Data

Analyte Name

Tolcapone-d4

CAS Number

1246816-93-2

Molecular Formula

C14H7D4NO5

Molecular Weight

277.27

Accurate Mass

277.0888

SMILES

O=C(C1=C([2H])C([2H])=C(C)C([2H])=C1[2H])C2=CC(O)=C(O)C([N+]([O-])=O)=C2

InChI

InChI=1S/C14H11NO5/c1-8-2-4-9(5-3-8)13(17)10-6-11(15(19)20)14(18)12(16)7-10/h2-7,16,18H,1H3/i2D,3D,4D,5D

Unlabelled CAS Number

134308-13-7

SIL Type

Deuterium

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

API

Product Format

Neat

API Family

Tolcapone

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