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367931

2-Bromo-4-fluorobenzoic acid

Name: 2-Bromo-4-fluorobenzoic acid
Brand: ALDRICH

97%

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About This Item

Linear Formula:

BrC₆H₃(F)CO₂H

CAS Number:

1006-41-3

Molecular Weight:

219.01

NACRES:

NA.22

PubChem Substance ID:

24862867

UNSPSC Code:

12352100

MDL number:

MFCD00055370

Assay:

97%

Form:

solid

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Properties

assay

97%

form

solid

mp

172-176 °C (lit.)

SMILES string

OC(=O)c1ccc(F)cc1Br

InChI

1S/C7H4BrFO2/c8-6-3-4(9)1-2-5(6)7(10)11/h1-3H,(H,10,11)

InChI key

RRKPMLZRLKTDQV-UHFFFAOYSA-N

Description

General description

Amination of 2-bromo-4-fluorobenzoic acid with aniline is reported to yield N-phenyl-4-fluoro-anthranilic acid.

Application

2-Bromo-4-fluorobenzoic acid may be used in the synthesis of:

3-fluoro-8-(methylthio)dibenzo[b,f]thiepin-10(11H)-one
2-fluoro-8-(methylthio)dibenzo[b,f]thiepin-10(11H)-one
2-((2-carboxy-5-fluorophenyl)amino)-3-methoxybenzoic acid
2-bromo-4-fluorobenzamide

pictograms

GHS07

signalword

Warning

hcodes

H315,H319,H335

pcodes

P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

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Neuroleptics with protracted action: 3-Fluoro derivatives of methiothepin and oxyprothepin and their 2-fluoro analogues.

Kopicova Z, et al.

Collection of Czechoslovak Chemical Communications, 40(11), 3519-3529 (1975)

Radiosynthesis and in vivo evaluation of 1-[18F]fluoroelacridar as a positron emission tomography tracer for P-glycoprotein and breast cancer resistance protein.

Bernd Dörner et al.

Bioorganic & medicinal chemistry, 19(7), 2190-2198 (2011-03-23)

Aim of this study was to label the potent dual P-glycoprotein (Pgp) and breast cancer resistance protein (BCRP) inhibitor elacridar (1) with (18)F to provide a positron emission tomography (PET) radiotracer to visualize Pgp and BCRP. A series of new

Rapid synthesis and zebrafish evaluation of a phenanthridine-based small molecule library.

Lauren R Donaldson et al.

Organic & biomolecular chemistry, 9(7), 2233-2239 (2011-02-08)

A Heck cyclisation approach is described for the rapid synthesis of a library of natural product-like small molecules, based on the phenanthridine core. The synthesis of a range of substituted benzylamine building blocks and their incorporation into the library is

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Global Trade Item Number

SKU	GTIN
5815-25GM	04055977242416
10724815001	04061838674692
11411446001	04061838701701
420291-100GM	04055977210859
420291-1GM	04055977210835
420291-1KG	04055977210842
420291-5GM	07790788050108
420322-10GM	07790788055622
420322-1KG	04055977210569
420322-500GM	07790788050153
I6758-1G	04061835367078
I6758-10G	04061835367061
I6758-5G	04061835367085
I5502-1G	04061838446190
I1284-5ML	04061833847640
PHG0010-5G	04061832608594
PHG0010-1000G	04061826004838
15-2461-3-5G-J	04061832684895
420290-5GM	04055977210828
420322-100GM	07790788050146
420322-1GM	04055977210552