(S)-alpha-(Aminomethyl)-3-hydroxybenzyl alcohol hydrochloride

Base Information

• Chemical Name: (S)-alpha-(Aminomethyl)-3-hydroxybenzyl alcohol hydrochloride
• CAS No.: 43090-68-2
• Molecular Formula: C8H12ClNO2
• Molecular Weight: 189.642
• Hs Code.: 2922509090
• European Community (EC) Number: 256-083-0
• DSSTox Substance ID: DTXSID40195686
• Mol file: 43090-68-2.mol

Synonyms:43090-68-2;(S)-alpha-(Aminomethyl)-3-hydroxybenzyl alcohol hydrochloride;EINECS 256-083-0;3-[(1S)-2-amino-1-hydroxyethyl]phenol;hydrochloride;DTXSID40195686;NS00089108

Chemical Property of (S)-alpha-(Aminomethyl)-3-hydroxybenzyl alcohol hydrochloride

Chemical Property:

• Boiling Point: 360.7°Cat760mmHg
• Flash Point: 172°C
• PSA: 66.48000
• Density: g/cm³
• LogP: 1.88660
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 189.0556563
• Heavy Atom Count: 12
• Complexity: 119

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC(=C1)O)C(CN)O.Cl
• Isomeric SMILES: C1=CC(=CC(=C1)O)[C@@H](CN)O.Cl

Technology Process of (S)-alpha-(Aminomethyl)-3-hydroxybenzyl alcohol hydrochloride

There total 3 articles about (S)-alpha-(Aminomethyl)-3-hydroxybenzyl alcohol hydrochloride which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

(+/-)-norphenylephrine hydrochloride (4779-94-6) → (-)m-octopamine hydrochloride (636-87-3,4779-94-6,15308-34-6,43090-68-2)

Guidance literature:

Reference yield:

(+/-)-norphenylephrine hydrochloride (4779-94-6) → (+)m-octopamine hydrochloride (43090-68-2) + (-)-m-octopamine (636-87-3)

Guidance literature:

With chiral stationary phase including isopropyl-functionalized CF₆; In methanol; acetic acid; triethylamine; acetonitrile; at 20 ℃; Purification / work up;

Reference yield:

(+/-)-norphenylephrine hydrochloride (4779-94-6) → (+)m-octopamine hydrochloride (43090-68-2)

Guidance literature:

upstream raw materials:

(+/-)-norphenylephrine hydrochloride

Refernces

• 1、 Midgley, John M.,Thonoor, Mohan C.,Drake, Alex F.,Williams, Clyde M.,Koziol, Anna E.,Palenik, Gus J.. "The Resolution and Absolute Configuration by X-Ray Crystallography of the Isomeric Octopamines and Synephrines". . p. 963 - 970. Retrieved 2007/10/02.