Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
(2-Fluoro-phenyl)-methanesulfonyl chloride |
EINECS | N/A |
CAS No. | 24974-71-8 | Density | 1.465 g/cm3 |
PSA | 42.52000 | LogP | 2.97510 |
Solubility | N/A | Melting Point |
55 °C |
Formula | C7H6ClFO2S | Boiling Point | 288.97 °C at 760 mmHg |
Molecular Weight | 208.641 | Flash Point | 128.565 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | 22 | |
Molecular Structure | Hazard Symbols | C; Xi | |
Synonyms |
a-Toluenesulfonylchloride, o-fluoro- (8CI);(2-Fluorobenzyl)sulfonyl chloride; |
Article Data | 8 |
The CAS registry number of Benzenemethanesulfonylchloride, 2-fluoro- is 24974-71-8. The IUPAC name is (2-fluorophenyl)methanesulfonyl chloride. It belongs to the classes of Sulphonyl Chlorides; Thiophenes & Benzothiophenes; Sulphonyl Chlorides; Thiophenes & Benzothiophenes. In addition, the molecular formula is C7H6ClFO2S and the molecular weight is 208.6377.
Physical properties about Benzenemethanesulfonylchloride, 2-fluoro- are: (1)ACD/LogP: 2.06; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.06; (4)ACD/LogD (pH 7.4): 2.06; (5)ACD/BCF (pH 5.5): 21.78; (6)ACD/BCF (pH 7.4): 21.78; (7)ACD/KOC (pH 5.5): 315.8; (8)ACD/KOC (pH 7.4): 315.8; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 42.52 Å2; (13)Index of Refraction: 1.546; (14)Molar Refractivity: 45.14 cm3; (15)Molar Volume: 142.3 cm3; (16)Polarizability: 17.89 ×10-24cm3; (17)Surface Tension: 47 dyne/cm; (18)Density: 1.465 g/cm3; (19)Flash Point: 128.6 °C; (20)Enthalpy of Vaporization: 50.71 kJ/mol; (21)Boiling Point: 289 °C at 760 mmHg; (22)Vapour Pressure: 0.00393 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Fc1ccccc1CS(Cl)(=O)=O
(2)InChI: InChI=1/C7H6ClFO2S/c8-12(10,11)5-6-3-1-2-4-7(6)9/h1-4H,5H2
(3)InChIKey: CJDWSUDXKHLMCY-UHFFFAOYAT