Butanimidamide (107-90-4)

The Butanimidamide, with the CAS registry number 107-90-4, has the systematic name of (1E)-butanimidamide. It belongs to the product category of Pharmacetical. And the molecular formula of the chemical is C₄H₁₀N₂.

The characteristics of this chemical are as followings: (1)ACD/LogP: -0.24; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.24; (4)ACD/LogD (pH 7.4): -2.24; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 2; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 15.6 Å²; (13)Index of Refraction: 1.465; (14)Molar Refractivity: 24.61 cm³; (15)Molar Volume: 88.9 cm³; (16)Polarizability: 9.75×10^-24cm³; (17)Surface Tension: 34.4 dyne/cm; (18)Density: 0.96 g/cm³; (19)Flash Point: 24.7 °C; (20)Enthalpy of Vaporization: 35.54 kJ/mol; (21)Boiling Point: 117.2 °C at 760 mmHg; (22)Vapour Pressure: 17.6 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: [N@H]=C(N)CCC
(2)InChI: InChI=1/C4H10N2/c1-2-3-4(5)6/h2-3H2,1H3,(H3,5,6)
(3)InChIKey: RXKUYBRRTKRGME-UHFFFAOYAO