Compound Q&A
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?
Answer
![2-[3,6-Bis(dimethylamino)-9-xantheniumyl]-5-isothiocyanatobenzoate - 2-[3,6-bis(dimethylamino)-9-xantheniumyl]-6-isothiocyanatobenzoate (1:1)](https://static.chemtradehub.com/structs/951/95197-95-8-3f45.webp "2-[3,6-Bis(dimethylamino)-9-xantheniumyl]-5-isothiocyanatobenzoate - 2-[3,6-bis(dimethylamino)-9-xantheniumyl]-6-isothiocyanatobenzoate (1:1)")
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.
About
CAS No
95197-95-8
English Name
2-[3,6-Bis(dimethylamino)-9-xantheniumyl]-5-isothiocyanatobenzoate - 2-[3,6-bis(dimethylamino)-9-xantheniumyl]-6-isothiocyanatobenzoate (1:1)
Molecular Formula
C50H42N6O6S2
Molecular Weight
887.04 g/mol
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
Last Updated: 2025-10-14 19:01
![2-[3,6-Bis(dimethylamino)-9-xantheniumyl]-5-isothiocyanatobenzoate - 2-[3,6-bis(dimethylamino)-9-xantheniumyl]-6-isothiocyanatobenzoate (1:1) — Shanghai Yinxin Laboratory Equipment Co., Ltd.](https://static.chemtradehub.com/suppliers/67cdd97a57537e5c8069adfb/67cdd97a57537e5c8069adfb-logo.webp){kind=logo}
![2-[3,6-Bis(dimethylamino)-9-xantheniumyl]-5-isothiocyanatobenzoate - 2-[3,6-bis(dimethylamino)-9-xantheniumyl]-6-isothiocyanatobenzoate (1:1) — HuBeiBaiDuHuaXue Co Ltd](https://static.chemtradehub.com/suppliers/67cecc6f2b2de6e8e95a5cbe/67cecc6f2b2de6e8e95a5cbe-logo.webp){kind=logo}