This chemical is called (-)-2,5-Dimethoxy-4-iodoamphetamine hydrochloride, and its systematic name is 1-(4-iodo-2,5-dimethoxyphenyl)propan-2-amine hydrochloride (1:1). With the molecular formula of C11H16INO2.HCl, its molecular weight is 357.62. The CAS registry number of this chemical is 82864-02-6.
Other characteristics of the (-)-2,5-Dimethoxy-4-iodoamphetamine hydrochloride can be summarised as followings: (1)ACD/LogP: 2.61; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.43; (4)ACD/LogD (pH 7.4): 0.58; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 5.86; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 21.7 Å2; (13)Flash Point: 172.5 °C; (14)Enthalpy of Vaporization: 60.74 kJ/mol; (15)Boiling Point: 361.5 °C at 760 mmHg; (16)Vapour Pressure: 2.06E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: Ic1cc(OC)c(cc1OC)CC(N)C.Cl
2.InChI: InChI=1/C11H16INO2.ClH/c1-7(13)4-8-5-11(15-3)9(12)6-10(8)14-2;/h5-7H,4,13H2,1-3H3;1H
3.InChIKey: QVFDMWGKHUFODK-UHFFFAOYAH
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