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Basic information
- CAS
25327-89-3- Standard SMILES
C=CCOc1c(Br)cc(C(C)(C)c2cc(Br)c(OCC=C)c(Br)c2)cc1Br- InChIKey
PWXTUWQHMIFLKL-UHFFFAOYSA-N- Molecular formula
- C21H20Br4O2
- Average molar mass
- 624.005 g/mol
- Monoisotopic mass
- 619.81967828
Names & identifiers
- Preferred name
- Tetrabromobisphenol A diallyl ether
- IUPAC
- 1,1'-(Propane-2,2-diyl)bis{3,5-dibromo-4-[(prop-2-en-1-yl)oxy]benzene}
- English name
- 2,2',6,6'-Tetrabromobisphenol A diallyl ether
- Molecular formula
- C21H20Br4O2
- Molecular weight
- 624
Names & synonyms
TETRABROMOBISPHENOL A DIALLYL ETHERbe-51sr319FG-3200pyroguardsr319Tetrabromo Ethertbbpa allyl ether2-Bis(4-allyloxy-35-dibroMophenyl)propanePoly ether dibroMobenzene
Database identifiers
- CAS
25327-89-3、37769-31-6- PubChem CID
- 61972
- DTXSID
DTXSID2029327- ChEMBL
CHEMBL3185920- UNII
- 57LML2L4FA
- EC Number
- 246-850-8、253-659-3
- Nikkaji
- J193.903C
Properties
Physicochemical properties
- Melting point
- 118 · 118-120 °C(lit.)
- Boiling point
- 525 · 525.0±50.0 °C(Predicted)
- Density
- 1.678 · 1.678±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- Chloroform (Slightly), DMSO (Sparingly, Heated, Sonicated)
- form
- Solid
- color
- White to Off-White
- Water Solubility
- 0.312 ng/L · 0.312ng/L
- Henry's Law Constant
- 7.7 · 7.7×101 mol/(m3Pa) at 25℃, Zhang et al. (2010)
- InChI
- InChI=1S/C21H20Br4O2/c1-5-7-26-19-15(22)9-13(10-16(19)23)21(3,4)14-11-17(24)20(18(25)12-14)27-8-6-2/h5-6,9-12H,1-2,7-8H2,3-4H3
- InChIKey
- PWXTUWQHMIFLKL-UHFFFAOYSA-N
- SMILES
- C(C1=CC(Br)=C(OCC=C)C(Br)=C1)(C1=CC(Br)=C(OCC=C)C(Br)=C1)(C)C
- LogP
- 10.02 · 10.02
- CAS DataBase Reference
- 25327 · 25327-89-3(CAS DataBase Reference)
- FDA UNII
- 57 LML2L4FA · 57LML2L4FA
- EPA Substance Registry System
- Tetrabromobisphenol A diallyl ether (25327-89-3)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 320 · H320
- Precautionary statements
- 264 · P264-P305+P351+P338+P337+P313
- RIDADR
- 3152 · 3152
- WGK Germany
- 2 · 2
Safety & regulation
Safety data
- wgk
- 2
- tsca
- TSCA listed
- rtecs
- DA6127655
- ridadr
- 3152
- hs_code
- 29093090
- Toxicity
- LD50 oral in rat: > 5gm/kg
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- 9
- packing_group
- II
- Hazard statements
- H320
- REACH Registrations
- Active
- Precautionary statements
- P264-P305+P351+P338+P337+P313
Chemistry & industry
Applications
UsesTetrabromobisphenol A Allyl Ether is a brominated flame retardant.
Upstream & downstream products
Upstream raw materials
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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