Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
Thiazolo[5,4-b]pyridine-2(1H)-thione |
EINECS | N/A |
CAS No. | 57135-09-8 | Density | 1.56g/cm3 |
PSA | 92.82000 | LogP | 1.98000 |
Solubility | N/A | Melting Point |
>300°C |
Formula | C6H4N2S2 | Boiling Point | 343.9 °C at 760 mmHg |
Molecular Weight | 168.243 | Flash Point | 161.8 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 26-36/37/39 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | Xi,Xn | |
Synonyms |
2-Mercaptothiazolo[5,4-b]pyridine;[1,3]Thiazolo[5,4-b]pyridine-2-thiol; |
Article Data | 11 |
The Thiazolo[5,4-b]pyridine-2(1H)-thione, with CAS registry number 57135-09-8, has the systematic name of [1,3]thiazolo[5,4-b]pyridine-2(1H)-thione. Besides this, it is also called Pyrido[3,2-d][1,3]thiazole-2-thiol. And the chemical formula of this chemical is C6H4N2S2.
Physical properties of Thiazolo[5,4-b]pyridine-2(1H)-thione: (1)ACD/LogP: 0.89; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.88; (4)ACD/LogD (pH 7.4): 0.85; (5)ACD/BCF (pH 5.5): 2.77; (6)ACD/BCF (pH 7.4): 2.55; (7)ACD/KOC (pH 5.5): 72.08; (8)ACD/KOC (pH 7.4): 66.5; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 73.52 Å2; (13)Index of Refraction: 1.802; (14)Molar Refractivity: 45.9 cm3; (15)Molar Volume: 107.1 cm3; (16)Polarizability: 18.19×10-24cm3; (17)Surface Tension: 95.7 dyne/cm; (18)Density: 1.56 g/cm3; (19)Flash Point: 161.8 °C; (20)Enthalpy of Vaporization: 58.78 kJ/mol; (21)Boiling Point: 343.9 °C at 760 mmHg; (22)Vapour Pressure: 6.85E-05 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
The Thiazolo[5,4-b]pyridine-2(1H)-thione irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: S=C2Sc1ncccc1N2
(2)InChI: InChI=1/C6H4N2S2/c9-6-8-4-2-1-3-7-5(4)10-6/h1-3H,(H,8,9)
(3)InChIKey: WITYIAHCBUYCSY-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C6H4N2S2/c9-6-8-4-2-1-3-7-5(4)10-6/h1-3H,(H,8,9)
(5)Std. InChIKey: WITYIAHCBUYCSY-UHFFFAOYSA-N