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| CAS No.: | 1011487-94-7 |
|---|---|
| Name: | 3-PYRIDAZINEMETHANOL, 6-CHLORO- |
| Article Data: | 3 |
| Molecular Structure: | |
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| Formula: | C5H5ClN2O |
| Molecular Weight: | 144.56 |
| Synonyms: | (6-Chloropyridazin-3-yl)methanol; |
| Density: | 1.422 g/cm3 |
| Boiling Point: | 355.495 °C at 760 mmHg |
| Flash Point: | 168.798 °C |
| PSA: | 46.01000 |
| LogP: | 0.62230 |
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Specification
The CAS registry number of 3-Pyridazinemethanol,6-chloro- is 1011487-94-7. This chemical's molecular formula is C5H5ClN2O and molecular weight is 144.559. What's more, its systematic name is called (6-Chloropyridazin-3-yl)methanol.
Physical properties about 3-Pyridazinemethanol,6-chloro- are: (1)#of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 7.62; (5)ACD/KOC (pH 7.4): 7.62; (6)#H bond acceptors: 3; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 46.01 Å2; (10)Index of Refraction: 1.579; (11)Molar Refractivity: 33.782 cm3; (12)Molar Volume: 101.648 cm3; (13)Polarizability: 13.392×10-24 cm3; (14)Surface Tension: 61.782 dyne/cm; (15)Density: 1.422 g/cm3; (16)Flash Point: 168.798 °C; (17)Enthalpy of Vaporization: 63.381 kJ/mol; (18)Boiling Point: 355.495 °C at 760 mmHg; (19)Vapour Pressure: 0 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: c1cc(nnc1CO)Cl
(2) InChI: InChI=1/C5H5ClN2O/c6-5-2-1-4(3-9)7-8-5/h1-2,9H,3H2
(3) InChIKey: NEWRIXKPAGUARA-UHFFFAOYAQ