(S)-(-)-N-Isopropyl-1-phenylethylamine hydrochloride (116297-12-2)

The (S)-(-)-N-Isopropyl-1-phenylethylamine hydrochloride, with the CAS registry number 116297-12-2, has the systematic name of N-[(1S)-1-phenylethyl]propan-2-amine hydrochloride. And the molecular formula of the chemical is C₁₁H₁₇N^.HCl. What's more, it is a kind of hygroscopic chemical, so it should be stored in sealed containers, and keep dry and cool at the same time.

The characteristics of (S)-(-)-N-Isopropyl-1-phenylethylamine hydrochloride are as followings: (1)ACD/LogP: 2.75; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 12.03 Å² ; (7)Flash Point: 107.8 °C; (8)Enthalpy of Vaporization: 50.2 kJ/mol; (9)Boiling Point: 254.6 °C at 760 mmHg; (10)Vapour Pressure: 0.0135 mmHg at 25°C.

You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable protective clothing, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Cl.CC(C)N[C@@H](C)c1ccccc1
(2)InChI: InChI=1/C11H17N.ClH/c1-9(2)12-10(3)11-7-5-4-6-8-11;/h4-10,12H,1-3H3;1H/t10-;/m0./s1
(3)InChIKey: SVRDLWQPQZOASL-PPHPATTJBG