Basic Information | Post buying leads | Suppliers |
Name |
4-Iodoisothiazole |
EINECS | N/A |
CAS No. | 49602-28-0 | Density | 2.239 g/cm3 |
PSA | 41.13000 | LogP | 1.74770 |
Solubility | N/A | Melting Point |
N/A |
Formula | C3H2INS | Boiling Point | 116.4 °C at 760 mmHg |
Molecular Weight | 211.0241 | Flash Point | 24.2 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
4-Iodoisothiazole |
The CAS registry number of 4-Iodoisothiazole is 49602-28-0. This chemical's molecular formula is C3H2INS and molecular weight is 211.0241. Its systematic name is called 4-iodoisothiazole.
Physical properties of 4-Iodoisothiazole: (1)ACD/LogP: 1.84; (2)ACD/LogD (pH 5.5): 1.84; (3)ACD/LogD (pH 7.4): 1.84; (4)ACD/BCF (pH 5.5): 14.75; (5)ACD/BCF (pH 7.4): 14.76; (6)ACD/KOC (pH 5.5): 238.95; (7)ACD/KOC (pH 7.4): 239.01; (8)#H bond acceptors: 1; (9)Index of Refraction: 1.68; (10)Molar Refractivity: 35.63 cm3; (11)Molar Volume: 94.2 cm3; (12)Surface Tension: 58.1 dyne/cm; (13)Density: 2.239 g/cm3; (14)Flash Point: 24.2 °C; (15)Enthalpy of Vaporization: 34.01 kJ/mol; (16)Boiling Point: 116.4 °C at 760 mmHg; (17)Vapour Pressure: 21.7 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Ic1csnc1
(2)InChI: InChI=1/C3H2INS/c4-3-1-5-6-2-3/h1-2H
(3)InChIKey: ORPLUOOTMBZERD-UHFFFAOYAV