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Home Halogens 2-Bromo-4'-chloroacetophenone

2-Bromo-4'-chloroacetophenone

CAS No.:
536-38-9
Catalog Number:
AG003L2Y
Molecular Formula:
C8H6BrClO
Molecular Weight:
233.4896
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$19
- +
25g
98%
In Stock USA
United States
$38
- +
100g
98%
In Stock USA
United States
$113
- +
500g
98%
In Stock USA
United States
$450
- +
Product Description
Catalog Number:
AG003L2Y
Chemical Name:
2-Bromo-4'-chloroacetophenone
CAS Number:
536-38-9
Molecular Formula:
C8H6BrClO
Molecular Weight:
233.4896
MDL Number:
MFCD00000625
IUPAC Name:
2-bromo-1-(4-chlorophenyl)ethanone
InChI:
InChI=1S/C8H6BrClO/c9-5-8(11)6-1-3-7(10)4-2-6/h1-4H,5H2
InChI Key:
FLAYZKKEOIAALB-UHFFFAOYSA-N
SMILES:
BrCC(=O)c1ccc(cc1)Cl
EC Number:
208-631-5
UNII:
2R0V40DI4R
NSC Number:
8452
Properties
Complexity:
141  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.929g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.489g/mol
Monoisotopic Mass:
231.929g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Literature
Title Journal
1-(4-Chloro-phen-yl)-2-[4-hy-droxy-3-(3-meth-oxy-benzo-yl)-1,1-dioxo-2H-1λ(6),2-benzothia-zin-2-yl]ethanone. Acta crystallographica. Section E, Structure reports online 20120401
(2-Anilino-4-methyl-thia-zol-5-yl)(4-chloro-phen-yl)methanone. Acta crystallographica. Section E, Structure reports online 20120101
2-(4-Chloro-phen-yl)-2-oxoethyl 3,4-dimeth-oxy-benzoate. Acta crystallographica. Section E, Structure reports online 20111201
2-(4-Chloro-anilino)-1-(4-chloro-phen-yl)ethanone. Acta crystallographica. Section E, Structure reports online 20111201
2-(4-Chloro-phen-yl)-2-oxoethyl 4-methyl-benzoate. Acta crystallographica. Section E, Structure reports online 20111101
2-(4-Chloro-phen-yl)-2-oxoethyl 4-hy-droxy-benzoate. Acta crystallographica. Section E, Structure reports online 20111001
2-(4-Chloro-phen-yl)-2-oxoethyl 3-(trifluoro-meth-yl)benzoate. Acta crystallographica. Section E, Structure reports online 20110701
2-(4-Chloro-phen-yl)-2-oxoethyl 2,4-di-fluoro-benzoate. Acta crystallographica. Section E, Structure reports online 20110701
2-(4-Chloro-phen-yl)-2-oxoethyl 2-meth-oxy-benzoate. Acta crystallographica. Section E, Structure reports online 20110701
2-(4-Chloro-phen-yl)-2-oxoethyl benzoate. Acta crystallographica. Section E, Structure reports online 20110701
Switching reversibility to irreversibility in glycogen synthase kinase 3 inhibitors: clues for specific design of new compounds. Journal of medicinal chemistry 20110623
FT-IR and FT-Raman spectral investigation, computed IR intensity and Raman activity analysis and frequency estimation analysis on 4-chloro-2-bromoacetophenone using HF and DFT calculations. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20110201
6-(4-Chloro-phen-yl)-2-isobutyl-imidazo[2,1-b][1,3,4]thia-diazole. Acta crystallographica. Section E, Structure reports online 20110101
1-(4-Chloro-phen-yl)-2-[(3-phenyl-isoquinolin-1-yl)sulfan-yl]ethanone. Acta crystallographica. Section E, Structure reports online 20090201
Precolumn derivatization of cysteine residues for quantitative analysis of five major cytochrome P450 isoenzymes by liquid chromatography/tandem mass spectrometry. Rapid communications in mass spectrometry : RCM 20070101
Thienyl and phenyl alpha-halomethyl ketones: new inhibitors of glycogen synthase kinase (GSK-3beta) from a library of compound searching. Journal of medicinal chemistry 20031023
Properties