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Home Halogens Benzene,1,2,3,4,5-pentabromo-6-ethyl-

Benzene,1,2,3,4,5-pentabromo-6-ethyl-

CAS No.:
85-22-3
Catalog Number:
AG004Q8W
Molecular Formula:
C8H5Br5
Molecular Weight:
500.6453
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Product Description
Catalog Number:
AG004Q8W
Chemical Name:
Benzene,1,2,3,4,5-pentabromo-6-ethyl-
CAS Number:
85-22-3
Molecular Formula:
C8H5Br5
Molecular Weight:
500.6453
MDL Number:
MFCD00000061
IUPAC Name:
1,2,3,4,5-pentabromo-6-ethylbenzene
InChI:
InChI=1S/C8H5Br5/c1-2-3-4(9)6(11)8(13)7(12)5(3)10/h2H2,1H3
InChI Key:
FIAXCDIQXHJNIX-UHFFFAOYSA-N
SMILES:
CCc1c(Br)c(Br)c(c(c1Br)Br)Br
EC Number:
201-593-0
UNII:
697LYO57KP
Properties
Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
499.627g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
500.648g/mol
Monoisotopic Mass:
495.631g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.2  
Literature
Title Journal
Deposition of brominated flame retardants to the Devon Ice Cap, Nunavut, Canada. Environmental science & technology 20120117
Presence and partitioning properties of the flame retardants pentabromotoluene, pentabromoethylbenzene and hexabromobenzene near suspected source zones in Norway. Journal of environmental monitoring : JEM 20110301
Bioaccumulation of several brominated flame retardants and dechlorane plus in waterbirds from an e-waste recycling region in South China: associated with trophic level and diet sources. Environmental science & technology 20110115
Polymeric brominated flame retardants: are they a relevant source of emerging brominated aromatic compounds in the environment? Environmental science & technology 20081215
Novel flame retardants, 1,2-bis(2,4,6-tribromophenoxy)ethane and 2,3,4,5,6-pentabromoethylbenzene, in United States' environmental samples. Environmental science & technology 20050415
Screening of halogenated aromatic compounds in some raw material lots for an aluminium recycling plant. Environment international 20040501
Properties