2,2′,3,4,4′-Pentabromodiphenyl ether
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2,2′,3,4,4′-Pentabromodiphenyl ether
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CAS No:
182346-21-0
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Formula:
C12H5Br5O
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Chemical Name:
2,2′,3,4,4′-Pentabromodiphenyl ether
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Synonyms:
Benzene,1,2,3-tribromo-4-(2,4-dibromophenoxy)-;1,2,3-Tribromo-4-(2,4-dibromophenoxy)benzene;BDE 85;PBDE 85;2,2′,3,4,4′-Pentabromodiphenyl ether
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CAS No:
Description
2,4-dibromophenyl 2,3,4-tribromophenyl ether is a polybromodiphenyl ether that is diphenyl ether in which the hydrogens at the 2, 3, 4, 2', and 4' positions have been replaced by bromines.
2,2′,3,4,4′-Pentabromodiphenyl ether Basic Attributes
564.69
564.69
208-759-1
FGO8T80EZ5
DTXSID4052685
Characteristics
9.23000
8.02
2.3±0.1 g/cm3
123-124 °C @ Solvent: Diethyl ether
439.3±45.0 °C at 760 mmHg
-12 °C
1.681
2-8°C
1.67E-07mmHg at 25°C
176.4 Ų [M-Br+O]-
Safety Information
UN12623/PG2
2
11-38-50/53-65-67
60-61-62-33-29-16-9
F,Xn,N
P210-P261-P273-P301 + P310-P331-P501
H225-H304-H315-H336-H410
|Warning|H362 (100%): May cause harm to breast-fed children [Reproductive toxicity, effects on or via lactation]|P201, P260, P263, P264, P270, P273, P308+P313, P314, P391, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:564.7
XLogP3:6.9
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:563.62163
Monoisotopic Mass:559.62573
Topological Polar Surface Area:9.2
Heavy Atom Count:18
Complexity:277
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2,2′,3,4,4′-Pentabromodiphenyl ether
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