2-[3,6-Bis(dimethylamino)-9-xantheniumyl]-5-isothiocyanatobenzoate - 2-[3,6-bis(dimethylamino)-9-xantheniumyl]-6-isothiocyanatobenzoate (1:1) | CAS No. 95197-95-8

2-[3,6-Bis(dimethylamino)-9-xantheniumyl]-5-isothiocyanatobenzoate - 2-[3,6-bis(dimethylamino)-9-xantheniumyl]-6-isothiocyanatobenzoate (1:1)

Basic Information

CAS Number

95197-95-8

Molecular Formula

C50H42N6O6S2

Molecular Weight

887.04 g/mol

AD

Basic Physical Properties

CN(C)c1ccc2c(c1)[o+]c3cc(ccc3c2c4cccc(c4C(=O)[O-])N=C=S)N(C)C.CN(C)c1ccc2c(c1)[o+]c3cc(ccc3c2c4ccc(cc4C(=O)[O-])N=C=S)N(C)C

InChI

InChI=1S/2C25H21N3O3S/c1-27(2)16-6-9-19-22(12-16)31-23-13-17(28(3)4)7-10-20(23)24(19)18-8-5-15(26-14-32)11-21(18)25(29)30;1-27(2)15-8-10-17-21(12-15)31-22-13-16(28(3)4)9-11-18(22)23(17)19-6-5-7-20(26-14-32)24(19)25(29)30/h2*5-13H,1-4H3

InChIKey

DTICYSNQBDFZSM-UHFFFAOYSA-N

Safety Information

View Safety Information

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation
H317 May cause an allergic skin reaction
Sensitization, Skin
H319 Causes serious eye irritation
Serious eye damage/eye irritation
H334 May cause allergy or asthma symptoms or breathing difficulties if inhaled
Sensitization, respiratory
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Sensitiveness

Light, Air & Moisture Sensitive

Synonyms & References

English

  • TRITC
  • TETRAMETHYLRHODAMINE-6-ISOTHIOCYANATE
  • TETRAMETHYLRHODAMINE B ISOTHIOCYANATE
  • TETRAMETHYLRHODAMINE 5(6)-ISOTHIOCYANATE
  • TETRAMETHYLRHODAMINE-5-(AND-6)-ISOTHIOCYANATE
  • TETRAMETHYLRHODAMINE ISOTHIOCYANATE
  • TETRAMETHYLRHODAMINE ISOTHIOCYANATE ISOMER R
  • MORPHOLINORHODAMINE ISOTHIOCYANATE
  • 5(6)-TRITC 5(6)-Tetramethylrhodamine isothiocyanate
  • 5(6)-Tetramethylrhodamine isothiocyanate
  • 5(6)-TRITC
  • MRITC
  • Tetramethylrhodamine B isothiocyanate
  • 9-(2-Carboxyisothiocyanatophenyl)-3,6-bis(dimethylamino)xanthylium inner salt

MDL Number

MFCD00063517

Customs Code

2929100090

FAQ

What regulatory guidelines apply to 2-[3,6-Bis(dimethylamino)-9-xantheniumyl]-5-isothiocyanatobenzoate - 2-[3,6-bis(dimethylamino)-9-xantheniumyl]-6-isothiocyanatobenzoate (1:1) (CAS: 95197-95-8)?

This compound falls under various regulatory guidelines such as the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) for classification, Registration, Evaluation, Authorization, and Restriction of Chemicals (REACH) in the European Union, and the Food and Drug Administration (FDA) and Environmental Protection Agency (EPA) guidelines in the United States. Compliance with these regulations is essential for safe handling and use.

Are there alternatives to 2-[3,6-Bis(dimethylamino)-9-xantheniumyl]-5-isothiocyanatobenzoate - 2-[3,6-bis(dimethylamino)-9-xantheniumyl]-6-isothiocyanatobenzoate (1:1) (CAS: 95197-95-8) in synthesis?

There are alternative isomers and analogs that can be used in synthesis, such as 2-[3,6-bis(dimethylamino)-9-xantheniumyl]-5-isothiocyanatobenzoate alone or 2-[3,6-bis(dimethylamino)-9-xantheniumyl]-6-isothiocyanatobenzoate alone. Substituting with these compounds can offer similar functionalities while potentially improving stability or reactivity.

What is the market or research trend for 2-[3,6-Bis(dimethylamino)-9-xantheniumyl]-5-isothiocyanatobenzoate - 2-[3,6-bis(dimethylamino)-9-xantheniumyl]-6-isothiocyanatobenzoate (1:1) (CAS: 95197-95-8)?

The market and research trends for this compound indicate increasing interest in its application in dyeing, photodynamic therapy, and luminescent materials. Research is focusing on optimizing its properties and exploring new applications in advanced organic materials and sensors.

How should waste containing 2-[3,6-Bis(dimethylamino)-9-xantheniumyl]-5-isothiocyanatobenzoate - 2-[3,6-bis(dimethylamino)-9-xantheniumyl]-6-isothiocyanatobenzoate (1:1) (CAS: 95197-95-8) be handled?

Waste containing this compound should be carefully collected and disposed of in accordance with local hazardous waste regulations. Proper incineration or professional waste disposal services should be utilized to ensure environmental safety. Appropriate precautions should be taken to prevent environmental contamination during handling and disposal.

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