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Merck

528811

Sigma-Aldrich

2-氨基-5-溴苯甲酸甲酯

96%

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About This Item

线性分子式:
BrC6H3(NH2)CO2CH3
CAS号:
分子量:
230.06
MDL编号:
UNSPSC代码:
12352100
PubChem化学物质编号:
NACRES:
NA.22

质量水平

方案

96%

mp

72-74 °C (lit.)

官能团

bromo
ester

SMILES字符串

COC(=O)c1cc(Br)ccc1N

InChI

1S/C8H8BrNO2/c1-12-8(11)6-4-5(9)2-3-7(6)10/h2-4H,10H2,1H3

InChI key

QVNYNHCNNGKULA-UHFFFAOYSA-N

一般描述

Molecules of methyl 2-amino-5-bromobenzoate are linked by N-H...O bonds and consists of zigzag chains running along the b-axis direction. The nonlinear optical single crystal of M2A5B grown by Sankaranarayanan-Ramasamy (SR) Unidirectional growth method shows good optical transparency and mechanical stability.

应用

Methyl 2-amino-5-bromobenzoate may be used in the synthesis of:
  • methyl 5-bromo-2-(1H-pyrrol-1-yl)benzoate
  • methyl 5-bromo-2-{[(4-methylphenyl)sulfonyl]amino}-benzoate
  • (2-{[4-bromo-2-(methoxycarbonyl)phenyl]amino}-2-oxoethoxy)acetic acid
  • 7-bromo-2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-one

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

储存分类代码

11 - Combustible Solids

WGK

WGK 3

闪点(°F)

Not applicable

闪点(°C)

Not applicable

个人防护装备

dust mask type N95 (US), Eyeshields, Gloves


历史批次信息供参考:

分析证书(COA)

Lot/Batch Number

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Damien Boeglin et al.
Journal of combinatorial chemistry, 9(3), 487-500 (2007-03-16)
A convenient and reliable solid-phase strategy for the synthesis of di- and trisubstituted benzazepine derivatives was developed. 5-Amino-1-tert-butoxycarbonyl-2,3,4,5-tetrahydro-1H-benzo[b]azepine and 5-amino-1-tert-butoxycarbonyl-7-bromo-2,3,4,5-tetrahydro-1H-benzo[b]azepine G-protein coupled receptor-targeted (GPCR-targeted) scaffolds were efficiently synthesized in a six-step solution-phase process, immobilized on the acid-labile FMPB-AM resin, and
Unidirectional growth of Methyl 2-amino-5-bromobenzoate crystal by Sankaranarayanan-Ramasamy method and its characterization.
Parthasarathy M and Gopalakrishnan R.
Journal of Crystal Growth, 372, 100-104 (2013)
Methyl 2-amino-5-bromobenzoate.
Khan I, et al.
Acta Crystallographica Section E, Structure Reports Online, 67(8), o1887-o1887 (2011)
DongHoon Chung et al.
Probe Reports from the NIH Molecular Libraries Program, 2010 Feb 27 (Updated 2010 Oct 4) (2011-03-25)
West Nile Virus (WNV) is a mosquito-borne pathogen that causes febrile illness and, occasionally, encephalitis when transmitted to humans. Infection can cause significant health problems such as West Nile fever and neuroinvasive disease. The goal of the assay was to
Nagahisa Yamaoka et al.
Chemical & pharmaceutical bulletin, 59(2), 215-224 (2011-02-08)
Novel anthranilic acid derivatives having substituted N-acyl side chains were designed and synthesized for evaluation as plasminogen activator inhibitor-1 (PAI-1) inhibitors. Compounds with a 4-diphenylmethyl-1-piperazinyl moiety on the acyl side chains in general exhibited potent in vitro PAI-1 inhibitory activity

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