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2-[3,6-Bis(dimethylamino)-9-xantheniumyl]-5-isothiocyanatobenzoate - 2-[3,6-bis(dimethylamino)-9-xantheniumyl]-6-isothiocyanatobenzoate (1:1)(CAS: 95197-95-8)

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

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Basic Information

Molecular Formula
C50H42N6O6S2
Molecular Weight
887.04 g/mol

Chemical Identifiers

SMILES
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
InChIKey
DTICYSNQBDFZSM-UHFFFAOYSA-N

Database References

MDL Number
MFCD00063517

FAQ

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.
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.
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.
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.

Safety Notice

Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.

Always follow proper handling procedures

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