14176-49-9

The IUPAC name of Tiletamine is 2-(ethylamino)-2-thiophen-2-ylcyclohexan-1-one. With the CAS registry number 14176-49-9, it is also named as Cyclohexanone, 2-(ethylamino)-2-(2-thienyl)-. The classification codes are Anesthetics; Anesthetics, General; Anesthetics, dissociative; Anesthetics, intravenous; Anticonvulsants; Central Nervous System Agents; Central Nervous System Depressants. Additionally, it is proposed anesthetic with possible anticonvulsant and sedative properties. 

Physical properties about Tiletamine are: (1)ACD/LogP: 3.042; (2)ACD/LogD (pH 5.5): 1.75; (3)ACD/LogD (pH 7.4): 2.95; (4)ACD/BCF (pH 5.5): 6.14; (5)ACD/BCF (pH 7.4): 97.49; (6)ACD/KOC (pH 5.5): 54.73; (7)ACD/KOC (pH 7.4): 868.77; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Index of Refraction: 1.556; (12)Molar Refractivity: 63.669 cm³; (13)Molar Volume: 198.011 cm³ ; (14)Polarizability: 25.24 10-24cm³; (15)Surface Tension: 43.7519989013672 dyne/cm; (16)Density: 1.128 g/cm³; (17)Flash Point: 167.056 °C; (18)Enthalpy of Vaporization: 59.745 kJ/mol; (19)Boiling Point: 352.615 °C at 760 mmHg

You can still convert the following datas into molecular structure:
(1)InChI=1S/C12H17NOS/c1-2-13-12(11-7-5-9-15-11)8-4-3-6-10(12)14/h5,7,9,13H,2-4,6,8H2,1H3;
(2)InChIKey=QAXBVGVYDCAVLV-UHFFFAOYSA-N;
(3)Smilesc1([C@@]2(C(CCCC2)=O)NCC)cccs1;