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Name |
3(2H)-Pyridazinone,4-bromo-5-(4-morpholinyl)- |
EINECS | N/A |
CAS No. | 5592-57-4 | Density | 1.84 g/cm3 |
PSA | 58.22000 | LogP | 0.43400 |
Solubility | N/A | Melting Point |
N/A |
Formula | C8H10BrN3O2 | Boiling Point | N/A |
Molecular Weight | 260.09 | Flash Point | N/A |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
3(2H)-Pyridazinone,4-bromo-5-morpholino- (7CI,8CI);NSC 66072;4-Bromo-5-(morpholin-4-yl)pyridazin-3(2H)-one; |
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