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127044-59-1

127044-59-1 Structure

127044-59-1 Structure
IdentificationBack Directory
[Name]

8-HYDROXY-N,N,N',N',N'',N''-HEXAMETHYLPYRENE-1,3,6-TRISULFONAMIDE
[CAS]

127044-59-1
[Synonyms]

A 205
8-HYDROXYPYRENE-1,3,6-TRIS(DIMETHYLSULFONAMIDE)
8-hydroxy-hexamethylpyrene-1,3,6-tri-sulfonamide
8-Hydroxy-N,N,N',N',N",N"-hexamethyl-pyrene-1,3,6-trisulfomide
8-Hydroxy-N,N,N',N',N",N"-hexamethyl-pyrene-1,3,6-trisulfomide
8-HYDROXY-N,N,N',N',N'',N''-HEXAMETHYLPYRENE-1,3,6-TRISULFONAMIDE
8-Hydroxy-N,N,N',N',N'',N''-hexamethyl-pyrene-1,3,6-trisulfonamide
1,3,6-Pyrenetrisulfonamide, 8-hydroxy-N1,N1,N3,N3,N6,N6-hexamethyl-
8-hydroxy-1-N,1-N,3-N,3-N,6-N,6-N-hexamethylpyrene-1,3,6-trisulfonamide
8-Hydroxy-N,N,N',N',N\\,N\\"-hexamethylpyrene-1,3,6-trisulfonamide suitable for fluorescence, >=95% (HPCE)"
[Molecular Formula]

C22H25N3O7S3
[MDL Number]

MFCD00037576
[MOL File]

127044-59-1.mol
[Molecular Weight]

539.64
Chemical PropertiesBack Directory
[Melting point ]

276 °C(lit.)
[Boiling point ]

780.7±70.0 °C(Predicted)
[density ]

1.511±0.06 g/cm3(Predicted)
[solubility ]

DMF: soluble
[form ]

solid
[pka]

6.02±0.30(Predicted)
[InChI]

1S/C22H25N3O7S3/c1-23(2)33(27,28)18-11-17(26)13-7-8-15-19(34(29,30)24(3)4)12-20(35(31,32)25(5)6)16-10-9-14(18)21(13)22(15)16/h7-12,26H,1-6H3
[InChIKey]

IMRMTOQIIAICNM-UHFFFAOYSA-N
[SMILES]

CN(C)S(=O)(=O)c1cc(O)c2ccc3c(cc(c4ccc1c2c34)S(=O)(=O)N(C)C)S(=O)(=O)N(C)C
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-36
[WGK Germany ]

3
[F ]

8-10
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Uses]

suitable as pH-indicator
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