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Product Overview

Product Code

TRC-B633330

CAS Number

63333-35-7

Product Format

Neat

Molecular Formula

C14 H7 Br3 F3 N3 O4

Molecular Weight

577.93

Product Categories

TRC, Pesticide & Metabolite Reference Materials and Research Chemicals , Pesticide and Metabolite Reference Materials , Pharmaceutical Toxicology Reference Materials

Product Type

Contaminant

Purity

>95% (HPLC)

Documentation

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Product Information

Chemical Data

Analyte Name

Bromethalin

CAS Number

63333-35-7

Molecular Formula

C14 H7 Br3 F3 N3 O4

Molecular Weight

577.93

Accurate Mass

574.7939

SMILES

CN(c1c(Br)cc(Br)cc1Br)c2c(cc(cc2C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H7Br3F3N3O4/c1-21(13-9(16)2-6(15)3-10(13)17)12-8(14(18,19)20)4-7(22(24)25)5-11(12)23(26)27/h2-5H,1H3

IUPAC

N-methyl-2,4-dinitro-N-(2,4,6-tribromophenyl)-6-(trifluoromethyl)aniline

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Transport Restrictions

Cargo Aircaft Only Air Excepted Air Dangerous

Product Format

Neat

Purity

>95% (HPLC)

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