2-Benzothiazolesulfenamide,N-(2-benzothiazolylthio)-N-(1,1-dimethylethyl)- (3741-80-8)

The 2-Benzothiazolesulfenamide,N-(2-benzothiazolylthio)-N-(1,1-dimethylethyl)- , with cas registry number of 3741-80-8, has many synonyms such as N-Benzothiazol-2-ylsulfanyl-N-tert-butyl-benzothiazole-2-sulfenamide ; N-(2-Benzothiazolylthio)-N-(1,1-dimethylethyl)-2-benzothiazolesulfenamide ; Vulcanization Accelerator . Its IUPAC name is called N,N-bis(1,3-benzothiazol-2-ylsulfanyl)-2-methylpropan-2-amine . And its systematic name is called N,N-bis(1,3-benzothiazol-2-ylsulfanyl)-2-methylpropan-2-amine . As a commercial product, it has its own trade name which is called Santocure TBSI . This compound belongs to the product categories of TSCA Flag P.

Physical properties of 2-Benzothiazolesulfenamide,N-(2-benzothiazolylthio)-N-(1,1-dimethylethyl)- : (1) H bond acceptors: 3 ; (2) H bond donors: 0 ; (3) Freely Rotating Bonds: 5 ; (4) Index of Refraction: 1.762 ; (5) Molar Refractivity: 116.89 cm³ ; (6) Molar Volume: 283.4 cm³ ; (7) Surface Tension: 75.6 dyne/cm ; (8) Enthalpy of Vaporization: 82.47 kJ/mol ; (9) Vapour Pressure: 5.73E-12 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The 2-Benzothiazolesulfenamide,N-(2-benzothiazolylthio)-N-(1,1-dimethylethyl)- is very toxic to aquatic organisms and may cause long-term adverse effects in the aquatic environment. So Avoid release to the environment. This compound and its container must be disposed of as hazardous waste and should be stored in a cool, dry place.

You can still convert the following datas into molecular structure:
(1) SMILES:n1c4ccccc4sc1SN(Sc2nc3ccccc3s2)C(C)(C)C ;
(2) InChI:InChI=1/C18H17N3S4/c1-18(2,3)21(24-16-19-12-8-4-6-10-14(12)22-16)25-17-20-13-9-5-7-11-15(13)23-17/h4-11H,1-3H3 ;
(3) InChIKey:VILGDADBAQFRJE-UHFFFAOYAZ