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Benzenesulfonylchloride, 3-[(6-methyl-2-pyrazinyl)oxy]-

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Name

Benzenesulfonylchloride, 3-[(6-methyl-2-pyrazinyl)oxy]-

EINECS N/A
CAS No. 926921-65-5 Density 1.427g/cm3
PSA 77.53000 LogP 3.58560
Solubility N/A Melting Point 83-85.5°C
Formula C11H9ClN2O3S Boiling Point 415.9 °C at 760 mmHg
Molecular Weight 284.71876 Flash Point 205.3 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 926921-65-5 (3-[(6-Methylpyrazin-2-yl)oxy]benzenesulphonyl chloride) Hazard Symbols CorrosiveC
Synonyms

3-[(6-Methylpyrazin-2-yl)oxy]benzenesulphonyl chloride;3-[(6-Methylpyrazin-2-yl)oxy]benzenesulphonyl chloride 97%;3-[(6-METHYLPYRAZIN-2-YL)OXY]BENZENESULFONYL CHLORIDE

 

Benzenesulfonylchloride, 3-[(6-methyl-2-pyrazinyl)oxy]- Specification

The Benzenesulfonylchloride, 3-[(6-methyl-2-pyrazinyl)oxy]-, with CAS registry number 926921-65-5, has the systematic name of 3-(6-methylpyrazin-2-yl)oxybenzenesulfonyl chloride. This chemical is corrosive. And the chemical formula of this chemical is C11H9ClN2O3S.

Physical properties of Benzenesulfonylchloride, 3-[(6-methyl-2-pyrazinyl)oxy]-: (1)ACD/LogP: 2.05; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.05; (4)ACD/LogD (pH 7.4): 2.05; (5)#H bond acceptors: 5; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 3; (8)Polar Surface Area: 77.53 Å2; (9)Index of Refraction: 1.587; (10)Molar Refractivity: 67.06 cm3; (11)Molar Volume: 199.3 cm3; (12)Polarizability: 26.58×10-24cm3; (13)Surface Tension: 55.3 dyne/cm; (14)Density: 1.427 g/cm3; (15)Flash Point: 205.3 °C; (16)Enthalpy of Vaporization: 64.31 kJ/mol; (17)Boiling Point: 415.9 °C at 760 mmHg; (18)Vapour Pressure: 9.62E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1cncc(n1)Oc2cccc(c2)S(=O)(=O)Cl
(2)InChI: InChI=1/C11H9ClN2O3S/c1-8-6-13-7-11(14-8)17-9-3-2-4-10(5-9)18(12,15)16/h2-7H,1H3
(3)InChIKey: TZKVHSNSPBZGTE-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C11H9ClN2O3S/c1-8-6-13-7-11(14-8)17-9-3-2-4-10(5-9)18(12,15)16/h2-7H,1H3
(5)Std. InChIKey: TZKVHSNSPBZGTE-UHFFFAOYSA-N

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