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Merck
CN

337013

Sigma-Aldrich

3-溴-4-氟甲苯

99%

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线性分子式:
CH3C6H3(Br)F
CAS号:
分子量:
189.02
EC 号:
MDL编号:
UNSPSC代码:
12352100
PubChem化学物质编号:
NACRES:
NA.22

检测方案

99%

折射率

n20/D 1.531 (lit.)

bp

169 °C/756 mmHg (lit.)

密度

1.507 g/mL at 25 °C (lit.)

SMILES字符串

Cc1ccc(F)c(Br)c1

InChI

1S/C7H6BrF/c1-5-2-3-7(9)6(8)4-5/h2-4H,1H3

InChI key

QLRKALMVPCQTMU-UHFFFAOYSA-N

应用

3-Bromo-4-fluorotoluene was employed as starting reagent in the synthesis of [4-fluoro-3-(trimethylsilyl)benzyl]guanidine. It was also employed as benzyne precursor in the synthesis of 6-methyl-1,2,3,4-tetrahydro-2,3-(benzylidenedioxy)-1,4-ethenonapthalene.

象形图

Exclamation mark

警示用语:

Warning

危险声明

危险分类

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

靶器官

Respiratory system

WGK

WGK 3

闪点(°F)

closed cup

闪点(°C)

closed cup

个人防护装备

Eyeshields, Gloves, type ABEK (EN14387) respirator filter

法规信息

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New syntheses of benzobarrelenes.
Pu L and Grubbs RH.
The Journal of Organic Chemistry, 59(6), 1351-1353 (1994)
G Vaidyanathan et al.
Bioconjugate chemistry, 7(1), 102-107 (1996-01-01)
With 3-bromo-4-fluorotoluene as starting material, [4-fluoro-3-(trimethylsilyl)benzyl]guanidine was prepared in five steps in 1.5% overall yield. Radioiodination of this silicon precursor using N-chlorosuccinimide in trifluoroacetic acid at room temperature for 5 min gave (4-fluoro-3-[131I]-iodobenzyl)guanidine ([131I]FIBG) in 50-60% radiochemical yield. A byproduct

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