Cyclopropanecarboxylicacid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-,(1,3,4,5,6,7-hexahydro-1,3-dioxo-2H-isoindol-2-yl)methyl ester, (1R,3R)- (1166-46-7)

The D-Tetramethrin, with the CAS registry number 1166-46-7 and EINECS registry number 214-619-0, has the systematic name of (1,3-dioxo-1,3,4,5,6,7-hexahydro-2H-isoindol-2-yl)methyl (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylate. And the molecular formula of the chemical is C₁₉H₂₅NO₄.

The characteristics of D-Tetramethrin are as followings: (1)ACD/LogP: 4.78; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.78; (4)ACD/LogD (pH 7.4): 4.78; (5)ACD/BCF (pH 5.5): 2508.52; (6)ACD/BCF (pH 7.4): 2508.52; (7)ACD/KOC (pH 5.5): 9438.42; (8)ACD/KOC (pH 7.4): 9438.42; (9)#H bond acceptors: 5; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 63.68 Å²; (13)Index of Refraction: 1.557; (14)Molar Refractivity: 88.96 cm³; (15)Molar Volume: 276 cm³; (16)Polarizability: 35.26×10^-24cm³; (17)Surface Tension: 46.5 dyne/cm; (18)Density: 1.2 g/cm³; (19)Flash Point: 227.9 °C; (20)Enthalpy of Vaporization: 71.26 kJ/mol; (21)Boiling Point: 453.2 °C at 760 mmHg; (22)Vapour Pressure: 2.1E-08 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C1\C3=C(/C(=O)N1COC(=O)[C@@H]2[C@@H](\C=C(/C)C)C2(C)C)CCCC3
(2)InChI: InChI=1/C19H25NO4/c1-11(2)9-14-15(19(14,3)4)18(23)24-10-20-16(21)12-7-5-6-8-13(12)17(20)22/h9,14-15H,5-8,10H2,1-4H3/t14-,15+/m1/s1
(3)InChIKey: CXBMCYHAMVGWJQ-CABCVRREBH

The toxicity data is as follows: