The 6-Chloro-N-cyclopropyl-3-pyridazinamine, with the CAS registry number 941294-45-7, has the systematic name of 6-chloro-N-cyclopropyl-pyridazin-3-amine. It belongs to the product categories of Amines and Blocks. And the molecular formula of the chemical is C7H8ClN3.
The characteristics of 6-Chloro-N-cyclopropyl-3-pyridazinamine are as followings: (1)ACD/LogP: 0.03; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.03; (4)ACD/LogD (pH 7.4): 0.03 ; (5)#H bond acceptors: 3; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 1; (8)Polar Surface Area: 37.81 Å2; (9)Index of Refraction: 1.681; (10)Molar Refractivity: 44.13 cm3; (11)Molar Volume: 116.5 cm3; (12)Polarizability: 17.49×10-24cm3; (13)Surface Tension: 70.3 dyne/cm; (14)Density: 1.454 g/cm3; (15)Flash Point: 195 °C; (16)Enthalpy of Vaporization: 64.94 kJ/mol; (17)Boiling Point: 398.8 °C at 760 mmHg; (18)Vapour Pressure: 1.44E-06 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: c1cc(nnc1NC2CC2)Cl
(2)InChI: InChI=1/C7H8ClN3/c8-6-3-4-7(11-10-6)9-5-1-2-5/h3-5H,1-2H2,(H,9,11)
(3)InChIKey: ZBFZCCNIZKJPEM-UHFFFAOYAX
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