Thianthrene

Thianthrene Structure
Thianthrene structure
Common Name Thianthrene
CAS Number 92-85-3 Molecular Weight 216.322
Density 1.3±0.1 g/cm3 Boiling Point 344.9±12.0 °C at 760 mmHg
Molecular Formula C12H8S2 Melting Point 151-155 °C(lit.)
MSDS Chinese USA Flash Point 170.8±16.6 °C

Convenient QSAR model for predicting the complexation of structurally diverse compounds with β-cyclodextrins

Bioorg. Med. Chem. 17 , 896-904, (2009)

This paper reports a QSAR study for predicting the complexation of a large and heterogeneous variety of substances (233 organic compounds) with beta-cyclodextrins (beta-CDs). Several different theoretical molecular descriptors, calculated solely from the mole...

Aqueous solubility data for pressurized hot water extraction for solid heterocyclic analogs of anthracene, phenanthrene and fluorene.

J. Chromatogr. A. 1140(1-2) , 195-204, (2007)

We report the aqueous solubilities of phenanthrene and several solid three-ring aromatic heterocycles (phenanthridine, acridine, phenazine, thianthrene, phenothiazine, phenoxathiin, phenoxazine, carbazole, dibenzofuran, dibenzothiophene, and 4,6-dimethyldiben...

Oxidation of Thianthrene by the Ligninase of Phanerochaete chrysosporium.

Appl. Environ. Microbiol. 54(7) , 1858-60, (1988)

The oxidation of heterocyclic sulfur compounds reported to be part of the macrostructure of coal and petroleum was investigated. The oxidation of thianthrene solubilized in 10% dimethylformamide to thianthrene monosulfoxide in the presence of hydrogen peroxid...

[Experiences with thianthrol salve in dermatology].

Z. Haut. Geschlechtskr. 10(9) , 370-6, (1951)

Formation of thianthrene by a free radical mechanism.

Science 113(2930) , 208-10, (1951)

Ring inversion dynamics of derivatives of thianthrene di- and tetraoxide.

J. Org. Chem. 71(16) , 6248-50, (2006)

The ring inversion barrier for thianthrene tetraoxide was determined by making use of the variable temperature 13C NMR spectra of the 2,7-diisopropyl derivative (DeltaG(double dagger) = 6.5 kcal mol(-1)). The barrier is lower than that measured for a trans th...

A systematic resolution of sulfur in reticulated vitreous carbon using X-ray absorption spectroscopy.

Inorg. Chem. 45(24) , 9864-76, (2006)

Sulfur K-edge X-ray absorption spectroscopy (XAS) was used to characterize the approximately 0.1% sulfur found both in native reticulated vitreous carbon (RVC) foam and in RVC oxidatively modified using 0.2 M KMnO4 in 2 M H2SO4. Sulfur valences and functional...

Liver regeneration in rats partially hepatectomized following massive organ enlargement induced by thianthrene.

Res. Commun. Chem. Pathol. Pharmacol. 53(1) , 125-8, (1986)

Male rats were fed a diet supplemented with 0.12% thianthrene or control chow for a period of 10 days after which they were partially hepatectomized, two-thirds of the organ being removed and continued on the diet or switched to the other for the last 10 days...

Cation recognition of thiacalix[2]thianthrene and p-tert-butylthiacalix[2]thianthrene and their conformers and complexes with Zn(II), Cd(II) and Hg(II): a theoretical investigation.

J. Mol. Model. 16(2) , 243-53, (2010)

The structures of thiacalix[2]thianthrene, p-tert-butylthiacalix[2]thianthrene and their complexes with Zn(2+), Cd(2+) and Hg(2+) were obtained using B3LYP/LanL2DZ and HF/LanL2DZ calculations. The structures of the most stable conformers of thiacalix[2]thiant...

Fate of thianthrene in rat.

Xenobiotica 28(1) , 93-101, (1998)

1. Radiolabelled thianthrene was administered by gavage (200 mg/kg body weight) to the adult female Wistar rat following an overnight fast. 2. Faeces was the major route of excretion of radioactivity (62%) with substantial amounts still being voided during th...