Basic information
- CAS
52256-80-1- Standard SMILES
CC(C)(c1ccc(Oc2cccc3c2C(=O)OC3=O)cc1)c1ccc(Oc2cccc3c2C(=O)OC3=O)cc1- InChIKey
NJWZAJNQKJUEKC-UHFFFAOYSA-N- Molecular formula
- C31H20O8
- Average molar mass
- 520.5 g/mol
- Monoisotopic mass
- 520.11581759
Names & identifiers
- Preferred name
- 1,3-Isobenzofurandione, 4,4'-((1-methylethylidene)bis(4,1-phenyleneoxy))bis-
- IUPAC
- 4-[4-[2-[4-[(1,3-dioxo-2-benzofuran-4-yl)oxy]phenyl]propan-2-yl]phenoxy]-2-benzofuran-1,3-dione
- English name
- 4,4'-(Dimethylmethylene)bis(1,4-phenyleneoxy)bis(isobenzofuran-1,3-dione)
- Molecular formula
- C31H20O8
- Molecular weight
- 520.49
Names & synonyms
1,3-Isobenzofurandione, 4,4'-[(1-methylethylidene)bis(4,1-phenyleneoxy)]bis-2,2-Bis(4-(2,3-dicarboxyphenoxy)phenyl)propane dianhydrideDTXSID60687271,3-Isobenzofurandione, 4,4'-((1-methylethylidene)bis(4,1-phenyleneoxy))bis-2,2-bis[4-(2,3-dicarboxyphenoxy)phenyl]propane dianhydrideRefChem:219342DTXCID404115752256-80-1SCHEMBL427290SCHEMBL29674513NJWZAJNQKJUEKC-UHFFFAOYSA-NDB-305164
Show more names
3,3-BPADA4,4'-[Isopropylidenebis(4,1-phenyleneoxy)]bis(isobenzofuran-1,3-dione)4,4'-[Isopropylidenebis[(4,1-phenylene)oxy]]bis(isobenzofuran-1,3-dione)4,4'-[(1-Methylethylidene)bis(4,1-phenyleneoxy)]bis(1,3-isobenzofurandione)4,4'-((propane-2,2-diylbis(4,1-phenylene))bis(oxy))bis(isobenzofuran-1,3-dione) 3,3-BPADA
4,4'-(Dimethylmethylene)bis(1,4-phenyleneoxy)bis(isobenzofuran-1,3-dione)4,4'-[Propane-2,2-diylbis(4,1-phenyleneoxy)]di(2-benzofuran-1,3-dione)
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 897
Physicochemical properties
- Boiling point
- 684.8 · 684.8±55.0 °C(Predicted)
- Density
- 1.406 · 1.406±0.06 g/cm3(Predicted)
- EPA Substance Registry System
- 1 · 1,3-Isobenzofurandione, 4,4'-[(1-methylethylidene)bis(4,1-phenyleneoxy)]bis- (52256-80-1)
- TSCA
- TSCA listed
- REACH Registrations
- Active
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationREACH registered substance: 4,4'-[2,2-Propanediylbis(4,1-phenyleneoxy)]bis(2-benzofuran-1,3-dione) (EC: 863-008-0)
Safety data
- tsca
- TSCA listed
- REACH Registrations
- Active
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,3-Isobenzofurandione, 4,4'-[(1-methylethylidene)bis(4,1-phenyleneoxy)]bis-: ACTIVE
Suppliers2 total
常州创索新材料科技有限公司+86-19901505185 +86-15312550623 · [email protected]
上海道利安试剂有限公司13122339260 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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