Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one, 6'-[ethyl(4-methylphenyl)amino]-3'-methyl-2'-[(4-methylphenyl)amino]-
Basic information
- CAS
63430-57-9- Standard SMILES
CCN(c1ccc(C)cc1)c1ccc2c(c1)Oc1cc(C)c(Nc3ccc(C)cc3)cc1C21OC(=O)c2ccccc21- InChIKey
NBGXBMYIFVBGPM-UHFFFAOYSA-N- Molecular formula
- C37H32N2O3
- Average molar mass
- 552.7 g/mol
- Monoisotopic mass
- 552.24129289
Names & identifiers
- Preferred name
- Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one, 6'-[ethyl(4-methylphenyl)amino]-3'-methyl-2'-[(4-methylphenyl)amino]-
- IUPAC
- 6'-(N-ethyl-4-methylanilino)-3'-methyl-2'-(4-methylanilino)spiro[2-benzofuran-3,9'-xanthene]-1-one
- English name
- 6'-[ethyl(p-tolyl)amino]-3'-methyl-2'-[(p-tolyl)amino]spiro[isobenzofuran-1(3H),9'-[9H]xanthene]-3-one
- Molecular formula
- C37H32N2O3
- Molecular weight
- 552.66
Names & synonyms
EINECS 264-142-7Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one, 6'-[ethyl(4-methylphenyl)amino]-3'-methyl-2'-[(4-methylphenyl)amino]-DTXSID408865823-(N-Ethyl-N-(p-tolyl))amino-6-methyl-7-p-toluidinofluoranSpiro(isobenzofuran-1(3H),9'-(9H)xanthen)-3-one, 6'-(ethyl(4-methylphenyl)amino)-3'-methyl-2'-((4-methylphenyl)amino)-RefChem:888790DTXCID40102590663430-57-96'-(Ethyl(p-tolyl)amino)-3'-methyl-2'-((p-tolyl)amino)spiro(isobenzofuran-1(3H),9'-(9H)xanthene)-3-oneNBGXBMYIFVBGPM-UHFFFAOYSA-NNS000560596'-[Ethyl(4-methylphenyl)amino]-3'-methyl-2'-(4-methylanilino)-3H-spiro[[2]benzofuran-1,9'-xanthen]-3-one
Show more names
2-(p-Toluidino)-3-methyl-6-(N-ethyl-p-toluidino)fluoran2'-(p-Toluidino)-3'-methyl-6'-[(p-tolyl)ethylamino]spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one6'-[ethyl(p-tolyl)amino]-3'-methyl-2'-[(p-tolyl)amino]spiro[isobenzofuran-1(3H),9'-[9H]xanthene]-3-one
Properties
Computed structural properties
- XLogP
- 8.8
- Topological polar surface area
- 50.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 941
Physicochemical properties
- EPA Substance Registry System
- -1 · Spiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one, 6'-[ethyl(4-methylphenyl)amino]-3'-methyl-2'-[(4-methylphenyl)amino]- (63430-57-9)
- 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 InformationSpiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one, 6'-[ethyl(4-methylphenyl)amino]-3'-methyl-2'-[(4-methylphenyl)amino]-: INACTIVE
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Compound notes
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