1-[2-(3,4-Dimethoxyphenyl)Ethylamino]-3-(4,5,6,7-Tetrahydrobenzothiophen-3-Yloxy)Propan-2-Ol Hydrochloride
[CAS# 85462-94-8]

Identification

• Name: 1-[2-(3,4-Dimethoxyphenyl)Ethylamino]-3-(4,5,6,7-Tetrahydrobenzothiophen-3-Yloxy)Propan-2-Ol Hydrochloride
• Synonyms: 1-[2-(3,4-Dimethoxyphenyl)Ethylamino]-3-(4,5,6,7-Tetrahydrobenzothiophen-3-Yloxy)Propan-2-Ol Hydrochloride; 1-(Homoveratrylamino)-3-(4,5,6,7-Tetrahydrobenzothiophen-3-Yloxy)Propan-2-Ol Hydrochloride; 2-Propanol, 1-((2-(3,4-Dimethoxyphenyl)Ethyl)Amino)-3-((4,5,6,7-Tetrahydrobenzo(B)Thien-3-Yl)Oxy)-, Hydrochloride
• Molecular Formula: C₂₁H₃₀ClNO₄S
• Molecular Weight: 427.99
• CAS Registry Number: 85462-94-8
• SMILES: [H+].C2=C(OCC(O)CNCCC1=CC(=C(OC)C=C1)OC)C3=C(S2)CCCC3.[Cl-]
• InChI: 1S/C21H29NO4S.ClH/c1-24-18-8-7-15(11-19(18)25-2)9-10-22-12-16(23)13-26-20-14-27-21-6-4-3-5-17(20)21;/h7-8,11,14,16,22-23H,3-6,9-10,12-13H2,1-2H3;1H
• InChIKey: HFMBJJKXWZVQBN-UHFFFAOYSA-N

Properties

• Boiling point: 584.6°C at 760 mmHg (Cal.)
• Flash point: 307.4°C (Cal.)