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CAS No.: | 957035-36-8 |
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Name: | 3-Chloro-6-(4-iodo-1H-pyrazol-1-yl)pyridazine |
Molecular Structure: | |
Formula: | C7H4ClIN4 |
Molecular Weight: | 306.4909 |
Synonyms: | 3-chloro-6-(4-iodopyrazol-1-yl)pyridazine;3-chloro-6-(4-iodo-1-pyrazolyl)pyridazine;3-Chloro-6-(4-iodo-1H-pyrazol-1-yl)pyridazine98% |
Density: | 2.18 g/cm3 |
Boiling Point: | 440.8 °C at 760 mmHg |
Flash Point: | 220.4 °C |
PSA: | 43.60000 |
LogP: | 1.92030 |
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The CAS registry number of 3-Chloro-6-(4-iodo-1H-pyrazol-1-yl)pyridazine is 957035-36-8. It belongs to the product categories of Blocks; Bromides; Imidazoles; Iodides; Pyridines. This chemical's molecular formula is C7H4ClIN4 and molecular weight is 306.4909. What's more, its systematic name is called 3-Chloro-6-(4-iodopyrazol-1-yl)pyridazine.
Physical properties about 3-Chloro-6-(4-iodo-1H-pyrazol-1-yl)pyridazine are: (1)ACD/LogP: 1.03; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.03; (4)ACD/LogD (pH 7.4): 1.03; (5)#H bond acceptors: 4; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 1; (8)Polar Surface Area: 43.6 Å2; (9)Index of Refraction: 1.803; (10)Molar Refractivity: 60.07 cm3; (11)Molar Volume: 140 cm3; (12)Polarizability: 23.81×10-24 cm3; (13)Surface Tension: 66.5 dyne/cm; (14)Density: 2.18 g/cm3; (15)Flash Point: 220.4 °C; (16)Enthalpy of Vaporization: 67.11 kJ/mol; (17)Boiling Point: 440.8 °C at 760 mmHg; (18)Vapour Pressure: 1.48E-07 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: InChI=1/C7H4ClIN4/c8-6-1-2-7(12-11-6)13-4-5(9)3-10-13/h1-4H
(2) InChI: InChI=1/C7H4ClIN4/c8-6-1-2-7(12-11-6)13-4-5(9)3-10-13/h1-4H
(3) InChIKey: ITGAMZMKSFYVNO-UHFFFAOYSA-N