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Basic information
- CAS
86456-20-4- Standard SMILES
Cc1ccc(S(=O)(=O)Oc2ccc3oc4cccc(NCCN(C)C)c4c(=O)c3c2)cc1- InChIKey
FGZKSRRBULAADD-UHFFFAOYSA-N- Molecular formula
- C24H24N2O5S
- Average molar mass
- 452.532 g/mol
- Monoisotopic mass
- 452.14059287
Names & identifiers
- Preferred name
- 8-((2-(Dimethylamino)ethyl)amino)-9-oxo-9H-xanthen-2-yl 4-methylbenzenesulfonate
- IUPAC
- 8-{[2-(Dimethylamino)ethyl]amino}-9-oxo-9H-xanthen-2-yl 4-methylbenzene-1-sulfonate
- English name
- 2-(Toluene-4-sulfonyloxy)-8-(2-dimethylamino-ethylamino)-xanthen-9-one
- Molecular formula
- C24H24N2O5S
- Molecular weight
- 452.52
Names & synonyms
2-(Toluene-4-sulfonyloxy)-8-(2-dimethylamino-ethylamino)-xanthen-9-one8-((2-(Dimethylamino)ethyl)amino)-9-oxo-9H-xanthen-2-yl 4-methylbenzenesulfonate9H-Xanthen-9-one, 1-[[2-(dimethylamino)ethyl]amino]-7-[[(4-methylphenyl)sulfonyl]oxy]-
Database identifiers
- CAS
86456-20-4- PubChem CID
- 337293
- DTXSID
DTXSID50235567- UNII
- PH5KNX6X2K
Properties
Physicochemical properties
- Boiling point
- 652.5 · 652.5±55.0 °C(Predicted)
- Density
- 1.331 · 1.331±0.06 g/cm3(Predicted)
- pka
- 9.09 · 9.09±0.28(Predicted)
- FDA UNII
- 5 KNX6X2K · PH5KNX6X2K
Chemistry & industry
Suppliers1 total
MATRIX[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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