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34419-05-1

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Basic Information
CAS No.: 34419-05-1
Name: N-METHYL-3,6-DITHIA-3,4,5,6-TETRAHYDROPHTHALIMIDE
Molecular Structure:
Molecular Structure of 34419-05-1 (N-METHYL-3,6-DITHIA-3,4,5,6-TETRAHYDROPHTHALIMIDE)
Formula: C7H7 N O2 S2
Molecular Weight: 201.27
Synonyms: p-Dithiin-2,3-dicarboximide,5,6-dihydro-N-methyl- (8CI); N-Methyl-5,6-dihydro-p-dithiin-2,3-dicarboximide
Density: 1.55g/cm3
Boiling Point: 326.8°Cat760mmHg
Flash Point: 151.4°C
Safety: Poison by intraperitoneal route. An experimental teratogen. Experimental reproductive effects. When heated to decomposition it emits very toxic fumes of NOx and SOx.
PSA: 87.98000
LogP: 0.61450
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Chemistry

Empirical Formula of N-Methyl-3,6-dithia-3,4,5,6-tetrahydrophthalimide (CAS NO.34419-05-1): C7H7NO2S2
Molecular Weight: 201.266 
Index of Refraction: 1.7
Density: 1.55 g/cm3
Flash Point: 151.4 °C
Enthalpy of Vaporization: 56.9 kJ/mol
Boiling Point: 326.8 °C at 760 mmHg
Vapour Pressure: 0.000211 mmHg at 25 °C
Structure of N-Methyl-3,6-dithia-3,4,5,6-tetrahydrophthalimide (CAS NO.34419-05-1):
                           
IUPAC Name: 6-Methyl-2,3-dihydro-[1,4]dithiino[2,3-c]pyrrole-5,7-dione
Canonical SMILES: CN1C(=O)C2=C(C1=O)SCCS2
InChI: InChI=1S/C7H7NO2S2/c1-8-6(9)4-5(7(8)10)12-3-2-11-4/h2-3H2,1H3
InChIKey: INNXFNOPKIFUDJ-UHFFFAOYSA-N

Toxicity Data With Reference

1.    

ipr-mus LD50:210 mg/kg

     DIPHAH    Dissertationes Pharmaceuticae. 23 (1971),113.

Safety Profile

Poison by intraperitoneal route. An experimental teratogen. Experimental reproductive effects. When heated to decomposition N-Methyl-3,6-dithia-3,4,5,6-tetrahydrophthalimide (CAS NO.34419-05-1) emits very toxic fumes of NOx and SOx.

Specification

 N-Methyl-3,6-dithia-3,4,5,6-tetrahydrophthalimide , its cas register number is 34419-05-1. It also can be called 5,6-Dihydro-N-methyl-p-dithiin-2,3-dicarboximide ; 6-Methyl-2,3,5,7-tetrahydro-6H-p-dithiino(2,3-c)pyrrole-5,7-dione ; and p-Dithiin-2,3-dicarboximide, 5,6-dihydro-N-methyl- .