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Merck
모든 사진(1)

문서

383406

Sigma-Aldrich

5′-Bromo-2′-hydroxyacetophenone

98%

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About This Item

Linear Formula:
BrC6H3(OH)COCH3
CAS Number:
Molecular Weight:
215.04
MDL number:
UNSPSC 코드:
12352100
PubChem Substance ID:
NACRES:
NA.22

분석

98%

형태

powder

mp

58-61 °C (lit.)

SMILES string

CC(=O)c1cc(Br)ccc1O

InChI

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

InChI key

HQCCNFFIOWYINW-UHFFFAOYSA-N

애플리케이션

5′-Bromo-2′-hydroxyacetophenone (5-Bromo-2-hydroxyacetophenone) may be used in the following studies:
  • As ligand in the preparation of tetrahedral metallocene complexes containing vanadium(IV) (vanadocene), having potential spermicidal activity against human sperm.
  • Synthesis of {2′-[1-(5-bromo-2-oxidophenyl) ethylidene] benzohydrazidato (2-)} tris(pyridine) nickel(II)] pyridine solvate.
  • Synthesis of N′-[1-(5-bromo-2-hydroxyphenyl)ethylidene]-3,4,5-trihydroxybenzohydrazide dimethyl sulfoxide solvate trihydrate.
  • Preparation of 6-bromochromen-4-one.

픽토그램

Exclamation mark

신호어

Warning

유해 및 위험 성명서

Hazard Classifications

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

표적 기관

Respiratory system

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point (°F)

Not applicable

Flash Point (°C)

Not applicable

개인 보호 장비

dust mask type N95 (US), Eyeshields, Gloves


시험 성적서(COA)

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문서 라이브러리 방문

Nura Suleiman Gwaram et al.
Acta crystallographica. Section E, Structure reports online, 66(Pt 3), o721-o721 (2010-01-01)
The benzohydrazide mol-ecule in the title compound, C(15)H(13)BrN(2)O(5)·C(2)H(6)OS·3H(2)O, is almost planar with an r.m.s. deviation for the non-H atoms of 0.078 Å. The organic mol-ecules, water and dimethyl sulfoxide solvent mol-ecules are linked by N-H⋯O, O-H⋯O and O-H⋯S inter-molecular hydrogen bonds
O J D'Cruz et al.
Biology of reproduction, 60(2), 435-444 (1999-01-23)
We have recently reported that tetrahedral metallocene complexes containing vanadium(IV) (vanadocene) have potent spermicidal activity against human sperm. The spermicidal activity was dependent on vanadium(IV) as the central metal ion within the bis-cyclopentadienyl (Cp2)-metal complex, but the variation of diacido
{2'-[1-(5-Bromo-2-oxidophenyl) ethylidene] benzohydrazidato (2-)} tris (pyridine) nickel (II)] pyridine solvate.
Ali HM, et al.
Acta Crystallographica Section E, Structure Reports Online, 60(11), m1708-m1709 (2004)
5'-Bromo-2'-hydroxyacetophenone.
Ng SW.
Acta Crystallographica Section E, Structure Reports Online, 63(4), o1805-o1806 (2007)
Justin J J Leahy et al.
Bioorganic & medicinal chemistry letters, 14(24), 6083-6087 (2004-11-18)
A solution-phase multiple-parallel synthesis approach was employed for the preparation of 6-, 7- and 8-aryl-substituted chromenone libraries, which were screened as inhibitors of the DNA repair enzyme DNA-dependent protein kinase (DNA-PK). These studies resulted in the identification of 8-dibenzothiophen-4-yl-2-morpholin-4-yl-chromen-4-one (NU7441)

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