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Product Overview

Product Code

TRC-B382050

EP Description

Bicalutamide EP Impurity E

Product Format

Neat

Molecular Formula

C18 H14 F4 N2 O3 S

Molecular Weight

414.374

Product Categories

Cancer Research Chemicals and Analytical Standards, Anticancerous, Anticancerous, TRC

Alternate CAS Number

Absolute stereochemistry: 1080647-25-1

Documentation

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Product Information

Chemical Data

Analyte Name

rel-(R*,R*)-Bicalutamide Sulfoxide

Molecular Formula

C18 H14 F4 N2 O3 S

Molecular Weight

414.374

Accurate Mass

414.066

SMILES

C[C@@](O)(C[S@@](=O)c1ccc(F)cc1)C(=O)Nc2ccc([N+]#[C-])c(c2)C(F)(F)F

InChI

InChI=1S/C18H14F4N2O3S/c1-17(26,10-28(27)13-6-3-11(19)4-7-13)16(25)24-12-5-8-15(23-2)14(9-12)18(20,21)22/h3-9,26H,10H2,1H3,(H,24,25)/t17-,28-/m1/s1

IUPAC

(2S)-3-[(R)-(4-fluorophenyl)sulfinyl]-2-hydroxy-N-[4-isocyano-3-(trifluoromethyl)phenyl]-2-methylpropanamide

Alternate CAS Number

Absolute stereochemistry: 1080647-25-1

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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