2,3-Quinoxalinedithione,1,4-dihydro-6-methyl- supplier

Name
6-Methylquinoxaline-2,3-dithiol
EINECS
CAS No. 25625-62-1
Article Data2
CAS DataBase
Density 1.42 g/cm³
Solubility
Melting Point
Formula C₉H₈N₂S₂
Boiling Point 343.8 °C at 760 mmHg
Molecular Weight 208.308
Flash Point 161.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2,3-Quinoxalinedithiol,6-methyl- (6CI,8CI);6-Methyl-2,3-quinoxalinedithiol;SAS 2061;
PSA 103.38000
LogP 2.51560

2,3-Quinoxalinedithione,1,4-dihydro-6-methyl- Specification

The 2,3-Quinoxalinedithione,1,4-dihydro-6-methyl-, also known as 6-Methyl-2,3-quinoxalinedithiol, is an organic compound with the formula C₉H₈N₂S₂. With the CAS registry number 25625-62-1, its IUPAC name is 6-methyl-1,4-dihydroquinoxaline-2,3-dithione.

Physical properties of 2,3-Quinoxalinedithione,1,4-dihydro-6-methyl-: (1)ACD/LogP: 2.24; (2)ACD/LogD (pH 5.5): 2.24; (3)ACD/LogD (pH 7.4): 2.18; (4)ACD/BCF (pH 5.5): 29.61; (5)ACD/BCF (pH 7.4): 25.82; (6)ACD/KOC (pH 5.5): 393.21; (7)ACD/KOC (pH 7.4): 342.84; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)Index of Refraction: 1.762; (11)Molar Refractivity: 60.11 cm³; (12)Molar Volume: 145.7 cm³; (13)Surface Tension: 83.3 dyne/cm; (14)Density: 1.42 g/cm³; (15)Flash Point: 161.8 °C; (16)Enthalpy of Vaporization: 58.77 kJ/mol; (17)Boiling Point: 343.8 °C at 760 mmHg; (18)Vapour Pressure: 6.85E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=CC2=C(C=C1)NC(=S)C(=S)N2
(2)InChI: InChI=1S/C9H8N2S2/c1-5-2-3-6-7(4-5)11-9(13)8(12)10-6/h2-4H,1H3,(H,10,12)(H,11,13)
(3)InChIKey: YTKGLURLTLIZJG-UHFFFAOYSA-N

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD50	intraperitoneal	249mg/kg (249mg/kg)		Journal of Pharmacology and Experimental Therapeutics. Vol. 173, Pg. 60, 1970.
rat	LD50	intraperitoneal	38mg/kg (38mg/kg)	BEHAVIORAL: MUSCLE WEAKNESS GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA"	Journal of Pharmacology and Experimental Therapeutics. Vol. 173, Pg. 60, 1970.

Product Name

6-Methylquinoxaline-2,3-dithiol

2,3-Quinoxalinedithione,1,4-dihydro-6-methyl- Specification

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