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Merck
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重要文件

264660

Sigma-Aldrich

3-溴-4-甲基苯甲酸

technical grade, 85%

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About This Item

線性公式:
Br(CH3)C6H3COOH
CAS號碼:
分子量::
215.04
EC號碼:
MDL號碼:
分類程式碼代碼:
12352100
PubChem物質ID:
NACRES:
NA.22
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等級

technical grade

化驗

85%

形狀

solid

mp

200-202 °C (lit.)
200-204 °C

官能基

bromo
carboxylic acid

SMILES 字串

Cc1ccc(cc1Br)C(O)=O

InChI

1S/C8H7BrO2/c1-5-2-3-6(8(10)11)4-7(5)9/h2-4H,1H3,(H,10,11)

InChI 密鑰

ZFJOMUKPDWNRFI-UHFFFAOYSA-N

應用

3-Bromo-4-methylbenzoic acid has been used in the synthesis of:
  • biphenyl amides[1]
  • 2-benzazepine-4-acetic acid derivative, as an analog of the potent, nonpeptide GPIIb/IIIa antagonist[2]
  • O-spiro C-aryl glucosides[3]

象形圖

Skull and crossbones

訊號詞

Danger

危險分類

Acute Tox. 3 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

標靶器官

Respiratory system

儲存類別代碼

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

水污染物質分類(WGK)

WGK 3

閃點(°F)

Not applicable

閃點(°C)

Not applicable

個人防護裝備

dust mask type N95 (US), Eyeshields, Faceshields, Gloves


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分析證明 (COA)

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Richard M Angell et al.
Bioorganic & medicinal chemistry letters, 18(1), 324-328 (2007-11-06)
The biphenyl amides are a novel series of p38 MAP kinase inhibitors. Structure-activity relationships of the series against p38alpha are discussed with reference to the X-ray crystal structure of an example. The series was optimised rapidly to a compound showing
Baihua Xu et al.
Bioorganic & medicinal chemistry letters, 19(19), 5632-5635 (2009-08-25)
Two series of O-spiro C-aryl glucosides were synthesized and tested for inhibition of hSGLT1 and hSGLT2. 6'-O-Spiro C-aryl glucosides exhibited potent in vitro hSGLT2 inhibitory activity but 2'-O-spiro C-aryl glucosides showed no in vitro hSGLT2 inhibitory activity at a screening
Wayne Huberty et al.
Journal of fluorescence, 26(2), 609-615 (2016-01-10)
A labeled green fluorescent polystyrene sulfonate (LNaPSS) has been synthesized using atom transfer radical polymerization of a styrene sulfonate monomer with a fluorescent co-monomer, fluorescein thiocyanate-vinyl aniline. As a result this 100 % sulfonated polymer contains no hydrophobic patches along
Synthesis of a 2-benzazepine analog of a potent, nonpeptide GPIIb/IIIa antagonist.
Miller WH, et al.
Tetrahedron Letters, 36(3), 373-376 (1995)

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