2,4-Dibromodiphenyl ether

Base Information

• Chemical Name: 2,4-Dibromodiphenyl ether
• CAS No.: 171977-44-9
• Molecular Formula: C12H8Br2O
• Molecular Weight: 327.99900
• UNII: M0M026GK5L
• DSSTox Substance ID: DTXSID70565813
• Nikkaji Number: J151.861E
• Wikidata: Q27283312
• Mol file: 171977-44-9.mol

Synonyms:2,4-dibromodiphenyl ether;171977-44-9;PBDE 7;Benzene, 2,4-dibromo-1-phenoxy-;2,4-Dibromo-1-phenoxybenzene;UNII-M0M026GK5L;M0M026GK5L;DTXSID70565813;2,4?DIBROMODIPHENYL ETHER;JMCIHKKTRDLVCO-UHFFFAOYSA-N;NS00077094;Q27283312

Chemical Property of 2,4-Dibromodiphenyl ether

Chemical Property:

• Melting Point: 158 °C
• Boiling Point: 327.9±27.0 °C(Predicted)
• PSA: 9.23000
• Density: 1.704±0.06 g/cm3(Predicted)
• LogP: 5.00390
• XLogP3: 4.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 327.89214
• Heavy Atom Count: 15
• Complexity: 192

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)OC2=C(C=C(C=C2)Br)Br
• Uses: PBDE 7 is a related compound of PBDE 37 (P215200). PBDE 37 is a polybrominated diphenyl ether, an organobromine compound, used as a flame retardant in consumer products. PBDE 37 is also an environment pollutant that may lead to pregnancy failure.

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