Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
Ethanone,1-[4-amino-2-(methylthio)-5-thiazolyl]- |
EINECS | N/A |
CAS No. | 39736-26-0 | Density | 1.38 g/cm3 |
PSA | 109.52000 | LogP | 2.23100 |
Solubility | N/A | Melting Point |
N/A |
Formula | C6H8N2OS2 | Boiling Point | 366.9 °C at 760 mmHg |
Molecular Weight | 188.274 | Flash Point | 175.7 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 36/37 | Risk Codes | 22-43 |
Molecular Structure | Hazard Symbols | Xn | |
Synonyms |
1-(4-Amino-2-(methylsulfanyl)-thiazol-5-yl)ethanone; |
Article Data | 7 |
The Ethanone,1-[4-amino-2-(methylthio)-5-thiazolyl]- is an organic compound with the formula C6H8N2OS2. The systematic name of this chemical is 1-[4-amino-2-(methylsulfanyl)-1,3-thiazol-5-yl]ethanone. With the CAS registry number 39736-26-0, it is also named as 1-[4-Amino-2-(methylthio)-5-thiazolyl]-ethanone.
Physical properties about Ethanone,1-[4-amino-2-(methylthio)-5-thiazolyl]- are: (1)ACD/LogP: 1.19; (2)#H bond acceptors: 3; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 3; (5)Polar Surface Area: 86.74 Å2; (6)Index of Refraction: 1.626; (7)Molar Refractivity: 48.31 cm3; (8)Molar Volume: 136.3 cm3; (9)Polarizability: 19.15×10-24cm3; (10)Surface Tension: 65.5 dyne/cm; (11)Density: 1.38 g/cm3; (12)Flash Point: 175.7 °C; (13)Enthalpy of Vaporization: 61.33 kJ/mol; (14)Boiling Point: 366.9 °C at 760 mmHg; (15)Vapour Pressure: 1.42E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1sc(SC)nc1N)C
(2)InChI: InChI=1/C6H8N2OS2/c1-3(9)4-5(7)8-6(10-2)11-4/h7H2,1-2H3
(3)InChIKey: UGESPDZKMNQVRQ-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C6H8N2OS2/c1-3(9)4-5(7)8-6(10-2)11-4/h7H2,1-2H3
(5)Std. InChIKey: UGESPDZKMNQVRQ-UHFFFAOYSA-N