Disodium 4,10-dibromodibenzo[def,mno]chrysene-6,12-diyl bis(sulphate)
Basic information
- CAS
10290-03-6- Standard SMILES
O=S(=O)([O-])Oc1c2cccc3c(Br)cc4c(OS(=O)(=O)[O-])c5cccc6c(Br)cc1c(c65)c4c32.[Na+].[Na+]- InChIKey
FQRHOYWBIFGUAP-UHFFFAOYSA-L- Molecular formula
- C22H8Br2Na2O8S2
- Average molar mass
- 670.2 g/mol
- Monoisotopic mass
- 667.78227
Names & identifiers
- Preferred name
- Disodium 4,10-dibromodibenzo[def,mno]chrysene-6,12-diyl bis(sulphate)
- IUPAC
- disodium;(9,18-dibromo-22-sulfonatooxy-12-hexacyclo[11.7.1.14,20.02,11.03,8.017,21]docosa-1,3(8),4,6,9,11,13,15,17(21),18,20(22)-undecaenyl) sulfate
- English name
- disodium 4,10-dibromodibenzo[def,mno]chrysene-6,12-diyl bis(sulphate)
- Molecular formula
- C22H11Br2NaO8S2
- Molecular weight
- 650.24
Names & synonyms
10290-03-6Disodium 4,10-dibromodibenzo(def,mno)chrysene-6,12-diyl bis(sulphate)EINECS 233-642-7Disodium 4,10-dibromodibenzo[def,mno]chrysene-6,12-diyl bis(sulphate)Disodium 4,10-dibromodibenzo(def,mno)chrysene-6,12-diylbis(sulphate)Dibenzo(def,mno)chrysene-6,12-diol, 4,10-dibromo-, bis(hydrogen sulfate), disodium saltDibenzo[def,mno]chrysene-6,12-diol, 4,10-dibromo-, bis(hydrogen sulfate), disodium saltRefChem:339139233-642-7disodium;(9,18-dibromo-22-sulfonatooxy-12-hexacyclo[11.7.1.14,20.02,11.03,8.017,21]docosa-1,3(8),4,6,9,11,13,15,17(21),18,20(22)-undecaenyl) sulfateFQRHOYWBIFGUAP-UHFFFAOYSA-Ldisodium 4,10-dibromonaphtho[7,8,1,2,3-nopqr]tetraphene-6,12-diyl disulfate
Show more names
Solubilised Vat Orange 3C.I.Solubilised Vat Orange 3 :C.I.59301Disodium 4,10-dibromodibenzo[def,mno]chrysene-6,12-diyl bis(sulfate)
DTXSID40908112DB-230272NS00054301Dibenzo(def,mno)chrysene-6,12-diol, 4,10-dibromo-, 6,12-bis(hydrogen sulfate), sodium salt (1:2)
Properties
Computed structural properties
- Topological polar surface area
- 150 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 2
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 918
Physicochemical properties
- EPA Substance Registry System
- -6 · Dibenzo[def,mno]chrysene-6,12-diol, 4,10-dibromo-, bis(hydrogen sulfate), disodium salt (10290-03-6)
- 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.
Hazard information
Regulatory InformationChemical: Dibenzo[def,mno]chrysene-6,12-diol, 4,10-dibromo-, bis(hydrogen sulfate), disodium salt
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationDibenzo[def,mno]chrysene-6,12-diol, 4,10-dibromo-, 6,12-bis(hydrogen sulfate), sodium salt (1:2): INACTIVE
Preparation methods
Preparation(a) in the presence of Pyridine , with Chlorosulfonic acid treatment C.I. Vat Orange 3 leuco ; (b) used in Pyridine metal (such as copper, iron, zinc, etc) and Sulfur trioxide source (such as Sulfur trioxide, Chlorosulfonic acid or Methyl chlorosulfonate) processing C.I. Vat Orange 3. The above two kinds of circumstances are through with alkali, filter out the insoluble,, remove Pyridine and salting-out.
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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