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BDE 99

BDE 99 structure

CAS No:
60348-60-9
Formula:
C12H5Br5O
Chemical Name:
BDE 99
Synonyms:
Benzene,1,2,4-tribromo-5-(2,4-dibromophenoxy)-;1,2,4-Tribromo-5-(2,4-dibromophenoxy)benzene;2,2′,4,4′,5-Pentabromodiphenyl ether;2,2′,4,4′,5-Pentabromodiphenyl oxide;Tardex 50;Tardex 50L;BDE 99;PBDE 99
Categories:
Analytical Chemistry > Standard

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Description

Liquid

BDE 99 Basic Attributes

Molecular Weight：

564.6875

Exact Mass：

564.69

EC Number：

208-759-1

HScode：

2909309090

Characteristics

PSA：

9.2

XLogP3：

6.84

Density：

2.25-2.28

Melting Point：

84-85 °C @ Solvent: Tetrahydrofuran, Water, Acetonitrile

Boiling Point：

416 °C

Flash Point：

-12 °C

Water Solubility：

9e-10 mg/mL at 20 °C

Storage Conditions：

2-8°C

Vapor Pressure：

3.50X10-7 mm Hg at 25 deg C

Safety Information

Transport codes：

UN12623/PG2

wgk germany：

hazard class code：

11-38-50/53-65-67

safety instructions：

60-61-62-33-29-16-9

RTECS Number：

DD6625350

Marks：

F,Xn,N

Precautionary statement(s)：

P201-P260-P263

Hazard Statements：

H362-H373-H410

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