712-80-1

The Benzenamine,N,N-dimethyl-4-(2-thiazolidinyl)-, with the CAS registry number 712-80-1, has the systematic name of N,N-dimethyl-4-(1,3-thiazolidin-2-yl)aniline. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C₁₁H₁₆N₂S.

The characteristics of Benzenamine,N,N-dimethyl-4-(2-thiazolidinyl)- are as followings: (1)ACD/LogP: 2.00; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.78; (4)ACD/LogD (pH 7.4): 0.83; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1.32; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 19.73; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 31.78 Å²; (13)Index of Refraction: 1.603; (14)Molar Refractivity: 64.1 cm³; (15)Molar Volume: 186.4 cm³; (16)Polarizability: 25.41×10^-24cm³; (17)Surface Tension: 45.4 dyne/cm; (18)Density: 1.117 g/cm³; (19)Flash Point: 174.7 °C; (20)Enthalpy of Vaporization: 61.15 kJ/mol; (21)Boiling Point: 365.2 °C at 760 mmHg; (22)Vapour Pressure: 1.6E-05 mmHg at 25°C. 

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: S2C(c1ccc(N(C)C)cc1)NCC2
(2)InChI: InChI=1/C11H16N2S/c1-13(2)10-5-3-9(4-6-10)11-12-7-8-14-11/h3-6,11-12H,7-8H2,1-2H3
(3)InChIKey: ISSWNDGJXPGDPC-UHFFFAOYAK

The toxicity data is as follows: