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3(2H)-Pyridazinone,4,5-dibromo-2-phenyl-

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Name

3(2H)-Pyridazinone,4,5-dibromo-2-phenyl-

EINECS 200-001-2
CAS No. 14305-08-9 Density 1.89 g/cm3
PSA 34.89000 LogP 2.75750
Solubility N/A Melting Point 143ºC
Formula C10H6Br2N2O Boiling Point 340.1 °C at 760 mmHg
Molecular Weight 329.978 Flash Point 159.5 °C
Transport Information N/A Appearance N/A
Safety Risk Codes  Xi:Irritant;
Molecular Structure Molecular Structure of 14305-08-9 (4,5-DIBROMO-2-PHENYL-2,3-DIHYDROPYRIDAZIN-3-ONE) Hazard Symbols IrritantXi
Synonyms

4,5-Dibromo-2-phenyl-3(2H)-pyridazinone;

Article Data 5

3(2H)-Pyridazinone,4,5-dibromo-2-phenyl- Specification

The 3(2H)-Pyridazinone,4,5-dibromo-2-phenyl-, with the CAS registry number 14305-08-9, is also known as 4,5-Dibromo-2-phenyl-3(2H)-pyridazinone. It belongs to the product categories of Halides; Pyrazines, Pyrimidines & Pyridazines; Pyrazines, Pyrimidines & Pyridazines. This chemical's molecular formula is C10H6Br2N2O and molecular weight is 329.97544. Its IUPAC name is called 4,5-dibromo-2-phenylpyridazin-3-one. When you are using this chemical, please be cautious about it. This chemical may cause inflammation to the skin or other mucous membranes. What's more, this chemical's classification code is Drug / Therapeutic Agent.

Physical properties of 3(2H)-Pyridazinone,4,5-dibromo-2-phenyl-: (1)ACD/LogP: 2.10; (2)#H bond acceptors: 3; (3)#Freely Rotating Bonds: 1; (4)Index of Refraction: 1.687; (5)Molar Refractivity: 66.5 cm3; (6)Molar Volume: 174.4 cm3; (7)Surface Tension: 56 dyne/cm; (8)Density: 1.89 g/cm3; (9)Flash Point: 159.5 °C; (10)Enthalpy of Vaporization: 58.36 kJ/mol; (11)Boiling Point: 340.1 °C at 760 mmHg; (12)Vapour Pressure: 8.82E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=C(C=C1)N2C(=O)C(=C(C=N2)Br)Br
(2)InChI: InChI=1S/C10H6Br2N2O/c11-8-6-13-14(10(15)9(8)12)7-4-2-1-3-5-7/h1-6H
(3)InChIKey: NQJXEMRMTOSSBQ-UHFFFAOYSA-N

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 300mg/kg (300mg/kg)   Farmaco, Edizione Scientifica. Vol. 40, Pg. 921, 1985.
mouse LD oral > 1gm/kg (1000mg/kg)   Farmaco, Edizione Scientifica. Vol. 40, Pg. 921, 1985.

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