Basic Information | Post buying leads | Suppliers |
Name |
3-Methyl-isothiazole-5-sulfonamide |
EINECS | N/A |
CAS No. | 1022128-99-9 | Density | 1.518 g/cm3 |
PSA | N/A | LogP | N/A |
Solubility | N/A | Melting Point |
N/A |
Formula | C4H6N2O2S2 | Boiling Point | 264.9 °C at 760 mmHg |
Molecular Weight | 178.2326 | Flash Point | 114 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
3-Methylisothiazole-5-sulfonamide; |
The CAS registry number of 3-Methyl-isothiazole-5-sulfonamide is 1022128-99-9. This chemical's molecular formula is C4H6N2O2S2 and molecular weight is 178.2326. What's more, its systematic name is called 3-Methylisothiazole-5-sulfonamide.
Physical properties about 3-Methyl-isothiazole-5-sulfonamide are: (1)#of Rule of 5 Violations: 0; (2)#H bond acceptors: 4; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 1; (5)Polar Surface Area: 109.67 Å2; (6)Index of Refraction: 1.592; (7)Molar Refractivity: 39.75 cm3; (8)Molar Volume: 117.3 cm3; (9)Polarizability: 15.75×10-24 cm3; (10)Surface Tension: 63.8 dyne/cm; (11)Density: 1.518 g/cm3; (12)Flash Point: 114 °C; (13)Enthalpy of Vaporization: 50.28 kJ/mol; (14)Boiling Point: 264.9 °C at 760 mmHg; (15)Vapour Pressure: 0.00944 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: Cc1cc(sn1)S(=O)(=O)N
(2) InChI: InChI=1/C4H6N2O2S2/c1-3-2-4(9-6-3)10(5,7)8/h2H,1H3,(H2,5,7,8)
(3) InChIKey: RLSOEMFZACXWRY-UHFFFAOYAZ