Chemical Properties of 2,2',4,4',5,-Penabromodiphenyl ether (CAS 60348-60-9)

2,2',4,4',5,-Penabromodiphenyl ether

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI
InChI=1S/C12H5Br5O/c13-6-1-2-11(9(16)3-6)18-12-5-8(15)7(14)4-10(12)17/h1-5H
InChI Key
WHPVYXDFIXRKLN-UHFFFAOYSA-N
Formula
C12H5Br5O
SMILES
Brc1ccc(Oc2cc(Br)c(Br)cc2Br)c(Br)c1
Molecular Weight1
564.69
CAS
60348-60-9
Other Names
  • 2,2',4,4',5-Pentabromodiphenyl ether
  • BDE-99
Sources

Physical Properties

Property Value Unit Source
Δf 193.43 kJ/mol Joback Calculated Property
Δfgas 124.13 kJ/mol Joback Calculated Property
Δfus 40.59 kJ/mol Joback Calculated Property
Δvap 84.75 kJ/mol Joback Calculated Property
logPoct/wat 7.29 Crippen Calculated Property
Pc 4723.61 kPa Joback Calculated Property
Tboil 905.44 K Joback Calculated Property
Tc 1206.95 K Joback Calculated Property
Tfus 661.67 K Joback Calculated Property
Vc 0.82 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 436.55 J/mol×K 905.44 Joback Calculated Property
η 0.00 Pa×s 905.44 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
=C< (ring) 7
-Br 5
=CH- (ring) 5

Similar Compounds

2,2',4,4',5,5'-Hexabromodiphenyl ether. Benzene, 1,1'-oxybis[pentabromo-. Dibromophenyl ether. 2,4,4'-Tribromodiphenyl ether. 3,3',4,4'-Tetrabromodiphenyl ether. 1,2,4,7,9-pentabromo-dibenzo-dioxin. octabromodibenzodioxin. 1,2,3,4,6,7,8-heptabromo-dibenzo-dioxin. 1,2,3,4,6,7,9-heptabromo-dibenzo-dioxin. 1,3,6,8-tetrabromo-dibenzo-dioxin. 1,3,7-tribromo-dibenzo-dioxin. 1,2,3,7,8-pentabromodibenzodioxin. 1,2,8,9-tetrabromo-dibenzo-dioxin. 2,3,4,6-Tetrabromophenol. Pentabromophenol.

Find more compounds similar to 2,2',4,4',5,-Penabromodiphenyl ether.

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.