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209511

2-Fluorobenzyl bromide

Name: 2-Fluorobenzyl bromide
Brand: ALDRICH

98%

Synonym(s):

α-Bromo-2-fluorotoluene

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About This Item

Linear Formula:

FC₆H₄CH₂Br

CAS Number:

446-48-0

Molecular Weight:

189.02

NACRES:

NA.22

PubChem Substance ID:

24852572

UNSPSC Code:

12352100

EC Number:

207-169-1

MDL number:

MFCD00000324

Assay:

98%

Form:

liquid

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Properties

assay

98%

form

liquid

refractive index

n20/D 1.552 (lit.)

bp

84-85 °C/15 mmHg (lit.)

density

1.567 g/mL at 25 °C (lit.)

functional group

bromo, fluoro

SMILES string

Fc1ccccc1CBr

InChI

1S/C7H6BrF/c8-5-6-3-1-2-4-7(6)9/h1-4H,5H2

InChI key

FFWQLZFIMNTUCZ-UHFFFAOYSA-N

Description

Application

2-Fluorobenzyl bromide was used:

in the synthesis of 2-pyrrolo[2,3-d]pyrimidines
as alkylating agent during the synthesis of 8-alkylated imidazolo[1,2-a]pyrimid-5-ones
in the synthesis of prasugrel

pictograms

GHS05,GHS07

signalword

Danger

hcodes

H314,H335

pcodes

P261 - P271 - P280 - P303 + P361 + P353 - P304 + P340 + P310 - P305 + P351 + P338

Hazard Classifications

Skin Corr. 1B - STOT SE 3

target_organs

Respiratory system

Storage Class

8A - Combustible corrosive hazardous materials

wgk

WGK 3

flash_point_f

181.4 °F - closed cup

flash_point_c

83 °C - closed cup

ppe

Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter

Regulatory Information

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Synthesis of prasugrel.

SUN Z-G, et al

Chinese Journal of Pharmaceuticals / Chung-kuo i yao kung yeh tsa chih, 4, 006-006 (2009)

Synthesis and anticonvulsant activity of N-benzylpyrrolo[2,3-d]-, -pyrazolo[3,4-d]-, and -triazolo[4,5-d]pyrimidines: imidazole ring-modified analogues of 9-(2-fluorobenzyl)-6-(methylamino)-9H-purine.

J L Kelley et al.

Journal of medicinal chemistry, 38(19), 3884-3888 (1995-09-15)

Analogues of 9-(2-fluorobenzyl)-6-(methylamino)-9H-purine (1) containing isosteric replacements of the imidazole ring atoms were synthesized and tested for anticonvulsant activity. The pyrrolo[2,3-d]-, pyrazolo[3,4-d]-, and triazolo[4,5-d]pyrimidines were less active than 1 against maximal electroshock-induced seizures (MES) in rats when given po. The

Initial structure-activity relationship studies of a novel series of pyrrolo[1,2-a]pyrimid-7-ones as GnRH receptor antagonists.

Yun-Fei Zhu et al.

Bioorganic & medicinal chemistry letters, 12(3), 399-402 (2002-01-30)

Initial SAR studies on 1-aminomethyl-2-aryl-3-cyano-pyrrolo[1,2-a]pyrimid-7-one-6-carboxylates as human GnRH receptor antagonists were discussed. 2-(2-Methylaminoethyl)pyridine was discovered to be a key feature for generating active compounds. The best compound from the series had 25 nM (K(i)) binding affinity to human GnRH receptor.

Global Trade Item Number

SKU	GTIN
209511-25G	04061838770745
209511-5G	04061838770752