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5592-57-4

Basic Information
CAS No.: 5592-57-4
Name: 4-bromo-5-morpholin-4-yl-2H-pyridazin-3-one
Molecular Structure:
Molecular Structure of 5592-57-4 (4-bromo-5-morpholin-4-yl-2H-pyridazin-3-one)
Formula: C8H10BrN3O2
Molecular Weight: 260.09
Synonyms: 3(2H)-Pyridazinone,4-bromo-5-morpholino- (7CI,8CI);NSC 66072;4-Bromo-5-(morpholin-4-yl)pyridazin-3(2H)-one;
Density: 1.84 g/cm3
PSA: 58.22000
LogP: 0.43400
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    4-bromo-5-morpholin-4-yl-2H-pyridazin-3-one CAS No.: 5592-57-4 Molecular formula: C8H10BrN3O2 4-bromo-5-morpholin-4-yl-2H-pyridazin-3-one 4-bromo-5-morpholin-4-yl-2H-pyridazin-3-one Use and synthesis Security Information MSDS inform

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    3(2H)-Pyridazinone,4-bromo-5-(4-morpholinyl)- cas 5592-57-4Appearance: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 3(2H)-Pyridazinone,4-bromo-5-(4-morpholinyl)- with CAS registry number of 5592-57-4 is also known as 4-Bromo-5-morpholin-4-yl-2H-pyridazin-3-one. The systematic name is 4-Bromo-5-(morpholin-4-yl)pyridazin-3(2H)-one. In addition, the formula is C8H10BrN3O2 and the molecular weight is 260.09.

Physical properties about 3(2H)-Pyridazinone,4-bromo-5-(4-morpholinyl)- are: (1)ACD/LogP: 0.38; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 5; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 45.14Å2; (7)Index of Refraction: 1.695; (8)Molar Refractivity: 54.17 cm3; (9)Molar Volume: 140.9 cm3; (10)Polarizability: 21.47×10-24cm3; (11)Surface Tension: 62.1 dyne/cm; (12)Density: 1.84 g/cm3.

You can still convert the following datas into molecular structure:
1. SMILES: Br/C1=C(/C=N\NC1=O)N2CCOCC2
2. InChI: InChI=1/C8H10BrN3O2/c9-7-6(5-10-11-8(7)13)12-1-3-14-4-2-12/h5H,1-4H2,(H,11,13)
3. InChIKey: ZHEGELZMEWDUKG-UHFFFAOYAS
4. Std. InChI: InChI=1S/C8H10BrN3O2/c9-7-6(5-10-11-8(7)13)12-1-3-14-4-2-12/h5H,1-4H2,(H,11,13)
5. Std. InChIKey: ZHEGELZMEWDUKG-UHFFFAOYSA-N