The cas register number of Thioflavine T is 2390-54-7. It also can be called as 2-[4-(Dimethylamino)phenyl]-3,6-dimethylbenzothiazolium chloride and the Systematic name about this chemical is 2-[4-(dimethylamino)phenyl]-3,6-dimethyl-1,3-benzothiazol-3-ium chloride. It belongs to the following product categories, such as Biochemistry, Vitamin Derivatives, Vitamins and so on. When you are using it, please avoid contact with skin and eyes.
Physical properties about Thioflavine T are: (1)#H bond acceptors: 2; (2)#Freely Rotating Bonds: 2; (3)Polar Surface Area: 35.36Å2.
You can still convert the following datas into molecular structure:
(1)SMILES: [Cl-].s2c1cc(ccc1[n+](c2c3ccc(N(C)C)cc3)C)C
(2)InChI: InChI=1/C17H19N2S.ClH/c1-12-5-10-15-16(11-12)20-17(19(15)4)13-6-8-14(9-7-13)18(2)3;/h5-11H,1-4H3;1H/q+1;/p-1
(3)InChIKey: JADWWWSKYZXRGX-REWHXWOFAC
(4)Std. InChI: InChI=1S/C17H19N2S.ClH/c1-12-5-10-15-16(11-12)20-17(19(15)4)13-6-8-14(9-7-13)18(2)3;/h5-11H,1-4H3;1H/q+1;/p-1
(5)Std. InChIKey: JADVWWSKYZXRGX-UHFFFAOYSA-M
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