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33098-13-4

Basic Information
CAS No.: 33098-13-4
Name: 4-(4,5-DICHLORO-6-OXOPYRIDAZIN-1(6H)-YL)BENZENESULFONAMIDE
Article Data: 1
Molecular Structure:
Molecular Structure of 33098-13-4 (4-(4,5-DICHLORO-6-OXOPYRIDAZIN-1(6H)-YL)BENZENESULFONAMIDE)
Formula: C10H7Cl2N3O3S
Molecular Weight: 320.156
Synonyms: 4-(4,5-Dichloro-6-oxopyridazin-1-yl)benzenesulfonamide;4-(4,5-Dichloro-6-oxopyridazin-1(6H)-yl)benzenesulfonamide;
Density: 1.72 g/cm3
Boiling Point: 483.4 °C at 760 mmHg
Flash Point: 246.1 °C
PSA: 103.43000
LogP: 2.96780
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    4-(4,5-DICHLORO-6-OXOPYRIDAZIN-1(6H)-YL)BENZENESULFONAMIDEAppearance:white crystalline powder Storage:Store in dry, dark and ventilated place Package:25KG drum Application:intermediate Transportation:by air, by sea, by express

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Specification

The Benzenesulfonamide, 4-(4,5-dichloro-6-oxo-1(6H)-pyridazinyl)-, with the CAS registry number 33098-13-4, is also known as 4-(4,5-Dichloro-6-oxopyridazin-1(6H)-yl)benzenesulfonamide. This chemical's molecular formula is C10H7Cl2N3O3S and molecular weight is 320.15. What's more, its systematic name is 4-(4,5-dichloro-6-oxopyridazin-1-yl)benzenesulfonamide.

Physical properties of Benzenesulfonamide, 4-(4,5-dichloro-6-oxo-1(6H)-pyridazinyl)- are: (1)ACD/LogP: -0.12; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.12; (4)ACD/LogD (pH 7.4): -0.12; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 20.47; (8)ACD/KOC (pH 7.4): 20.43; (9)#H bond acceptors: 6; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 78.43 Å2; (13)Index of Refraction: 1.709; (14)Molar Refractivity: 72.26 cm3; (15)Molar Volume: 185.1 cm3; (16)Polarizability: 28.64×10-24cm3; (17)Surface Tension: 70.4 dyne/cm; (18)Density: 1.72 g/cm3; (19)Flash Point: 246.1 °C; (20)Enthalpy of Vaporization: 74.84 kJ/mol; (21)Boiling Point: 483.4 °C at 760 mmHg; (22)Vapour Pressure: 1.69E-09 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=CC=C1N2C(=O)C(=C(C=N2)Cl)Cl)S(=O)(=O)N
(2)InChI: InChI=1S/C10H7Cl2N3O3S/c11-8-5-14-15(10(16)9(8)12)6-1-3-7(4-2-6)19(13,17)18/h1-5H,(H2,13,17,18)
(3)InChIKey: BJITVBXEZBGKCJ-UHFFFAOYSA-N