2,2',3,3',4,4',5-Heptabromodiphenyl ether

Base Information

• Chemical Name: 2,2',3,3',4,4',5-Heptabromodiphenyl ether
• CAS No.: 327185-13-7
• Molecular Formula: C12H3Br7O
• Molecular Weight: 722.4827
• UNII: 18JW9IML0M
• DSSTox Substance ID: DTXSID90879969
• Nikkaji Number: J248.353J
• Wikidata: Q27252016
• Mol file: 327185-13-7.mol

Synonyms:2,2',3,3',4,4',5-Heptabromodiphenyl ether;327185-13-7;PBDE 170;UNII-18JW9IML0M;18JW9IML0M;1,2,3,4-tetrabromo-5-(2,3,4-tribromophenoxy)benzene;Benzene, 1,2,3,4-tetrabromo-5-(2,3,4-tribromophenoxy)-;BDE-170;DTXSID90879969;Q27252016

Chemical Property of 2,2',3,3',4,4',5-Heptabromodiphenyl ether

Chemical Property:

• Boiling Point: 512.9±50.0 °C(Predicted)
• PSA: 9.23000
• Density: 2.643±0.06 g/cm3(Predicted)
• LogP: 8.81640
• XLogP3: 8.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 721.44060
• Heavy Atom Count: 20
• Complexity: 331

Purity/Quality:

99% ^*data from raw suppliers

PBDE170 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=C(C(=C1OC2=CC(=C(C(=C2Br)Br)Br)Br)Br)Br)Br
• Uses: PBDE 170 is a polybrominated di-?Ph ether (PBDE), which is a flame retardant often incorporated into many polymers. PBDEs are an environmental pollutant that exhibits potential health risks to humans and wildlife.