Home Other Building Blocks 2-Bromocyclohexa-2,5-diene-1,4-dione

2-Bromocyclohexa-2,5-diene-1,4-dione

CAS No.:
3958-82-5
Catalog Number:
AG003GM1
Molecular Formula:
C6H3BrO2
Molecular Weight:
186.9908
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
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United States
$426
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Product Description
Catalog Number:
AG003GM1
Chemical Name:
2-Bromocyclohexa-2,5-diene-1,4-dione
CAS Number:
3958-82-5
Molecular Formula:
C6H3BrO2
Molecular Weight:
186.9908
MDL Number:
MFCD00189377
IUPAC Name:
2-bromocyclohexa-2,5-diene-1,4-dione
InChI:
InChI=1S/C6H3BrO2/c7-5-3-4(8)1-2-6(5)9/h1-3H
InChI Key:
PYEQXZOIQJWYAH-UHFFFAOYSA-N
SMILES:
O=C1C=CC(=O)C(=C1)Br
Properties
Complexity:
225  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.932g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.992g/mol
Monoisotopic Mass:
185.932g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Literature
Title Journal
Complex dynamical behavior in the highly photosensitive cerium-bromate-1,4-benzoquinone reaction. The journal of physical chemistry. A 20120809
Electrospray ionization tandem mass spectrometric characterization of DNA adducts formed by bromobenzoquinones. Rapid communications in mass spectrometry : RCM 20111015
A versatile synthesis of fumaquinone. The Journal of organic chemistry 20100806
Synthesis of bromo-conduritol-B and bromo-conduritol-C as glycosidase inhibitors. Carbohydrate research 20090310
Total synthesis of (+)-neomarinone. Chemistry (Weinheim an der Bergstrasse, Germany) 20090101
Determination of the spectroscopic properties and chromatographic sensitivities of substituted quinones by hexachlorate(IV) oxidation of hydroquinones. Talanta 20080115
Site-specific arylation of rat glutathione s-transferase A1 and A2 by bromobenzene metabolites in vivo. Chemical research in toxicology 20061101
Alpha1-adrenergic receptors and their significance to chemical-induced nephrotoxicity--a brief review. Research communications in molecular pathology and pharmacology 20010101
Properties