Basic information
- CAS
94334-64-2- Standard SMILES
CC(C)(c1cc(Br)c(O)c(Br)c1)c1cc(Br)c(O)c(Br)c1.O=C(Cl)Cl.Oc1ccccc1- InChIKey
LJNDPOUIYDAJNC-UHFFFAOYSA-N- Molecular formula
- C22H18Br4Cl2O4
- Average molar mass
- 736.9 g/mol
- Monoisotopic mass
- 731.73156
Names & identifiers
- Preferred name
- Carbonyl dichloride;2,6-dibromo-4-[2-(3,5-dibromo-4-hydroxyphenyl)propan-2-yl]phenol;phenol
- IUPAC
- carbonyl dichloride;2,6-dibromo-4-[2-(3,5-dibromo-4-hydroxyphenyl)propan-2-yl]phenol;phenol
- English name
- TBBPA carbonate oligomer BC52
- Molecular formula
- C22H18Br4Cl2O4
- Molecular weight
- 736.89792
Names & synonyms
carbonyl dichloride;2,6-dibromo-4-[2-(3,5-dibromo-4-hydroxyphenyl)propan-2-yl]phenol;phenolSCHEMBL1674367LJNDPOUIYDAJNC-UHFFFAOYSA-NCID 160324BPC-52FR-RDT 6TBBPA carbonate oligTBBPA carbonate oligomerBrominated polycarbonatetbbpa carbonate oligomer bTBBPA carbonate oligomer BC52TETRABROMOBISPHENOLACARBONATEOLIGOMERS
Show more names
TIANFUCHEM: TBBPA carbonate oligomer BC52Poly(phenoxy-tetrabromobisphenolAcarbonate)
Database identifiers
- CAS
94334-64-2- PubChem CID
- 160324
Properties
Computed structural properties
- Topological polar surface area
- 77.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 385
Physicochemical properties
- Henry's Law Constant
- 4.2 · 4.2×107 mol/(m3Pa) at 25℃, Zhang et al. (2010)
- CAS DataBase Reference
- 94334 · 94334-64-2(CAS DataBase Reference)
- EPA Substance Registry System
- 4 · Carbonic dichloride, polymer with 4,4'-(1-methylethylidene)bis[2,6-dibromophenol] and phenol (94334-64-2)
- RIDADR
- 3152 · 3152
- TSCA
- TSCA listed
- HazardClass
- 9 · 9
- PackingGroup
- II
Safety & regulation
Safety data
- tsca
- TSCA listed
- ridadr
- 3152
- hazard_class
- 9
- packing_group
- II
Chemistry & industry
Suppliers42 total
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Related reactions
0 records
No reaction records under the current filter.
Compound notes
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