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Product Overview

Product Code

TRC-D480180

CAS Number

35897-25-7

Product Format

Neat

Molecular Formula

C11 H11 N3 O7 S

Molecular Weight

329.29

Product Categories

TRC

Documentation

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Product Information

Chemical Data

Analyte Name

S-(2,4-Dinitrophenyl)mercapturic Acid

CAS Number

35897-25-7

Molecular Formula

C11 H11 N3 O7 S

Molecular Weight

329.29

Accurate Mass

329.0318

SMILES

CC(=O)N[C@@H](CSc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C11H11N3O7S/c1-6(15)12-8(11(16)17)5-22-10-3-2-7(13(18)19)4-9(10)14(20)21/h2-4,8H,5H2,1H3,(H,12,15)(H,16,17)/t8-/m0/s1

IUPAC

(2R)-2-acetamido-3-(2,4-dinitrophenyl)sulfanylpropanoic acid

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

Product Description

Used as a marker for low levels of exposure to benzene in industry.

References: van Sittert, N.J., et al.: Br. J. Med., 50, 460 (1993), Boogaard, P.J. and van Sittert, H.J.: Occup. Environ. Med., 52, 611 (1995)

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