Home Halogens Bis(4-bromophenyl)ether

Bis(4-bromophenyl)ether

CAS No.:
2050-47-7
Catalog Number:
AG0029T4
Molecular Formula:
C12H8Br2O
Molecular Weight:
327.9993
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$25
- +
25g
98%
In Stock USA
United States
$50
- +
100g
98%
In Stock USA
United States
$125
- +
Product Description
Catalog Number:
AG0029T4
Chemical Name:
Bis(4-bromophenyl)ether
CAS Number:
2050-47-7
Molecular Formula:
C12H8Br2O
Molecular Weight:
327.9993
MDL Number:
MFCD00000095
IUPAC Name:
1-bromo-4-(4-bromophenoxy)benzene
InChI:
InChI=1S/C12H8Br2O/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12/h1-8H
InChI Key:
YAWIAFUBXXPJMQ-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)Oc1ccc(cc1)Br
EC Number:
218-090-7
UNII:
OS4N55HE2E
Properties
Complexity:
162  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.892g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
328.003g/mol
Monoisotopic Mass:
325.894g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  
Literature
Title Journal
Metabolism of polybrominated diphenyl ethers and tetrabromobisphenol A by fish liver subcellular fractions in vitro. Aquatic toxicology (Amsterdam, Netherlands) 20120615
Bioaccumulation, depuration and biotransformation of 4,4'-dibromodiphenyl ether in crucian carp (Carassius auratus). Chemosphere 20120201
Sorption-desorption behavior of polybrominated diphenyl ethers in soils. Environmental pollution (Barking, Essex : 1987) 20111001
Quantum chemical investigation on the mechanism and kinetics of PBDE photooxidation by ·OH: a case study for BDE-15. Environmental science & technology 20110601
Effect of decabromodiphenyl ether (BDE 209) and dibromodiphenyl ether (BDE 15) on soil microbial activity and bacterial community composition. Journal of hazardous materials 20110215
Vibrational spectroscopic investigation and DFT studies on 2,2',4,4'-tetrabromodiphenyl ether. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20101015
Experimental and theoretical study on molecular structure and FT-IR, Raman, NMR spectra of 4,4'-dibromodiphenyl ether. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20100901
Photodegradation of 2,2',4,4'-tetrabromodiphenyl ether in nonionic surfactant solutions. Chemosphere 20081101
Physicochemical properties of selected polybrominated diphenyl ethers and extension of the UNIFAC model to brominated aromatic compounds. Chemosphere 20070401
Gas-phase reactions of brominated diphenyl ethers with OH radicals. The journal of physical chemistry. A 20060921
Di-p-bromophenyl ether, a redetermined crystal structure derived from low-quality diffraction data. Acta crystallographica. Section B, Structural science 20041201
Anaerobic microbial and photochemical degradation of 4,4'-dibromodiphenyl ether. Water research 20030201
Properties