N,N,3-Trimethylpyrrolidin-3-amine (947149-88-4)

The N,N,3-Trimethylpyrrolidin-3-amine, with the CAS registry number 947149-88-4, is also called 3-pyrrolidinamine, N,N,3-trimethyl-. It is a kind of organiocs, and should be stored at dry and cool environment. The molecular formula of the chemical is C₇H₁₆N₂.

The characteristics of N,N,3-Trimethylpyrrolidin-3-amine are as followings: (1)ACD/LogP: 0.40; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 2; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 15.27 Å²; (11)Index of Refraction: 1.481; (12)Molar Refractivity: 39.947 cm³; (13)Molar Volume: 140.454 cm³; (14)Polarizability: 15.836×10^-24cm³; (15)Surface Tension: 31.074 dyne/cm; (16)Density: 0.913 g/cm³; (17)Flash Point: 46.39 °C; (18)Enthalpy of Vaporization: 39.713 kJ/mol; (19)Boiling Point: 160.525 °C at 760 mmHg; (20)Vapour Pressure: 2.375 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: CC1(CCNC1)N(C)C
(2)InChI: InChI=1/C7H16N2/c1-7(9(2)3)4-5-8-6-7/h8H,4-6H2,1-3H3
(3)InChIKey: BHGAPHJDUGWGCK-UHFFFAOYAV