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28200-51-3

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Basic Information
CAS No.: 28200-51-3
Name: 3-Ethyl Pyridazine
Molecular Structure:
Molecular Structure of 28200-51-3 (3-Ethyl Pyridazine)
Formula: C6H8N2
Molecular Weight: 108.14
Synonyms: 3-ethyl-2-cyano-2-methyl-pent-3-enoic acid ethyl ester;3-Aethyl-pyridazin;3-ethyl-pyridazine;3-Aethyl-2-cyan-2-methyl-pent-3-ensaeure-aethylester;
EINECS: 200-001-2
Density: 0.995 g/cm3
Boiling Point: 222.491 °C at 760 mmHg
Flash Point: 96.529 °C
PSA: 25.78000
LogP: 1.03900
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Specification

The 3-Ethylpyridazine, with the CAS registry number 28200-51-3, is also known as Pyridazine, 3-ethyl-. This chemical's molecular formula is C6H8N2 and molecular weight is 108.14. What's more, its systematic name is 3-Ethylpyridazine. 

Physical properties of 3-Ethylpyridazine are: (1)ACD/LogP: 0.221; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.22; (4)ACD/LogD (pH 7.4): 0.22; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 31.08; (8)ACD/KOC (pH 7.4): 31.43; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 25.78 Å2; (13)Index of Refraction: 1.5; (14)Molar Refractivity: 31.985 cm3; (15)Molar Volume: 108.698 cm3; (16)Polarizability: 12.68×10-24cm3; (17)Surface Tension: 39.3 dyne/cm; (18)Density: 0.995 g/cm3; (19)Flash Point: 96.529 °C; (20)Enthalpy of Vaporization: 44.028 kJ/mol; (21)Boiling Point: 222.491 °C at 760 mmHg; (22)Vapour Pressure: 0.2 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CCc1cccnn1
(2)Std. InChI: InChI=1S/C6H8N2/c1-2-6-4-3-5-7-8-6/h3-5H,2H2,1H3
(3)Std. InChIKey: VPHSTJOEAKXUBG-UHFFFAOYSA-N