1H-Isoindole-1,3(2H)-dione, 4,5,6,7-tetrabromo-2-(2,4,6-tribromophenyl)-
Basic information
- CAS
37710-57-9- Standard SMILES
O=C1c2c(Br)c(Br)c(Br)c(Br)c2C(=O)N1c1c(Br)cc(Br)cc1Br- InChIKey
MXOORBGSTYBSFP-UHFFFAOYSA-N- Molecular formula
- C14H2Br7NO2
- Average molar mass
- 775.5 g/mol
- Monoisotopic mass
- 768.43692
Names & identifiers
- Preferred name
- 1H-Isoindole-1,3(2H)-dione, 4,5,6,7-tetrabromo-2-(2,4,6-tribromophenyl)-
- IUPAC
- 4,5,6,7-tetrabromo-2-(2,4,6-tribromophenyl)isoindole-1,3-dione
- English name
- 4,5,6,7-Tetrabromo-2-(2,4,6-tribromophenyl)-1H-isoindole-1,3(2H)-dione
- Molecular formula
- C14H2Br7NO2
- Molecular weight
- 775.5
Names & synonyms
37710-57-91H-Isoindole-1,3(2H)-dione, 4,5,6,7-tetrabromo-2-(2,4,6-tribromophenyl)-N-(2,4,6-Tribromophenyl)-3,4,5,6-tetrabromophthalimideDTXSID2068050RefChem:438820DTXCID10393994,5,6,7-Tetrabromo-2-(2,4,6-tribromophenyl)-1H-isoindole-1,3(2H)-dione
Database identifiers
- CAS
37710-57-9- PubChem CID
- 3084669
- DTXSID
DTXSID2068050- Nikkaji
- J422.372A
Properties
Computed structural properties
- XLogP
- 7.3
- Topological polar surface area
- 37.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 505
Physicochemical properties
- Boiling point
- 698.9 · 698.9±65.0 °C(Predicted)
- Density
- 2.769 · 2.769±0.06 g/cm3(Predicted)
- pka
- -4.97 · -4.97±0.20(Predicted)
- EPA Substance Registry System
- 1 H-Isoindole-1,3 · 1H-Isoindole-1,3(2H)-dione, 4,5,6,7-tetrabromo-2-(2,4,6-tribromophenyl)- (37710-57-9)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1H-Isoindole-1,3(2H)-dione, 4,5,6,7-tetrabromo-2-(2,4,6-tribromophenyl)-: INACTIVE
Upstream & downstream products
Upstream raw materials
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Related reactions
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