The Benzenesulfonothioicacid, anhydrosulfide, with the CAS registry number 4388-22-1, is also known as NSC 85600. This chemical's molecular formula is C12H10O4S3 and molecular weight is 313.974121. Its IUPAC name is called benzenesulfonylsulfanylsulfonylbenzene. When you are using this chemical, please be cautious about it. You should avoid contacting it with skin and eyes. This chemical is off-white to pink powder and/or crystals.
Physical properties of Benzenesulfonothioicacid, anhydrosulfide: (1)ACD/LogP: 3.16; (2)#H bond acceptors: 4; (3)#Freely Rotating Bonds: 4; (4)Index of Refraction: 1.637; (5)Molar Refractivity: 77.11 cm3; (6)Molar Volume: 214.8 cm3; (7)Surface Tension: 56.5 dyne/cm; (8)Density: 1.463 g/cm3; (9)Flash Point: 259.7 °C; (10)Enthalpy of Vaporization: 74.62 kJ/mol; (11)Boiling Point: 505.8 °C at 760 mmHg; (12)Vapour Pressure: 7.4E-10 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=C(C=C1)S(=O)(=O)SS(=O)(=O)C2=CC=CC=C2
(2)InChI: InChI=1S/C12H10O4S3/c13-18(14,11-7-3-1-4-8-11)17-19(15,16)12-9-5-2-6-10-12/h1-10H
(3)InChIKey: YQUSJUJNDKUWAM-UHFFFAOYSA-N
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