N-Methyltyramine hydrochloride

Base Information

• Chemical Name: N-Methyltyramine hydrochloride
• CAS No.: 13062-76-5
• Molecular Formula: C9H13NO.ClH
• Molecular Weight: 187.669
• Hs Code.: 2922299090
• UNII: SMF2Z5E3WC
• DSSTox Substance ID: DTXSID50156642
• Mol file: 13062-76-5.mol

Synonyms:13062-76-5;N-Methyltyramine hydrochloride;N-Methyltyramine HCl;4-(2-(Methylamino)ethyl)phenol hydrochloride;4-[2-(methylamino)ethyl]phenol hydrochloride;N-Methyl-p-tyramine Hydrochloride;Phenol, p-(2-(methylamino)ethyl)-, hydrochloride;SMF2Z5E3WC;4-[2-(methylamino)ethyl]phenol;hydrochloride;p-(2-(Methylamino)ethyl)phenol hydrochloride;4-Hydroxy-beta-phenylethylmethylamine hydrochloride;N-Methyltyraminehydrochloride;N-Methylthyramin HCl;Phenol, 4-[2-(methylamino)ethyl]-, hydrochloride (1:1);UNII-SMF2Z5E3WC;4-[2-(Methylamino)ethyl]phenol,hydrochloride;4-Hydroxy-N-methylphenethylamine Hydrochloride;Methyl-p-tyramine Hydrochloride;N-Methyl tyramine hydrochloride;SCHEMBL19205971;DTXSID50156642;AMY12558;BCP10171;MFCD01707290;AKOS015889409;AS-11479;LS-104816;4-(2-(METHYLAMINO)ETHYL)PHENOL HCL;CS-0209581;FT-0655474;W16881;EN300-7361977;A806113;J-005839;J-523737;Methyl-4-tyramine hydrochloride,p-(2-Methylaminoethyl)phenol hydrochloride

Chemical Property of N-Methyltyramine hydrochloride

Chemical Property:

• Melting Point: 134-136°C
• Boiling Point: 270.9 °C at 760 mmHg
• Flash Point: 119.7 °C
• PSA: 32.26000
• LogP: 2.34700
• Storage Temp.: Refrigerator
• Solubility.: DMSO (Slightly), Methanol (Slightly), Water (Slightly)
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 187.0763918
• Heavy Atom Count: 12
• Complexity: 97.7

Purity/Quality:

99% ^*data from raw suppliers

N-Methyl-p-tyramineHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CNCCC1=CC=C(C=C1)O.Cl
• Uses: A component of beer which stimulates pancreatic exocrine secretion via cholinergic gastropancreatic reflex.

Technology Process of N-Methyltyramine hydrochloride

There total 5 articles about N-Methyltyramine 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: 93.0%

N-t-butoxycarbonyl-tyramine (64318-28-1) → N-Methyltyramine hydrochloride (13062-76-5)

Guidance literature:

N-t-butoxycarbonyl-tyramine; With lithium aluminium tetrahydride; In 1,4-dioxane; at 0 ℃; for 48h; Reflux;

With methanol; thionyl chloride;

DOI:10.1016/j.bmcl.2009.11.040

Reference yield:

2-(4-hydroxyphenyl)-N-methylacetamide (29121-34-4) → N-Methyltyramine hydrochloride (13062-76-5)

Guidance literature:

2-(4-hydroxyphenyl)-N-methylacetamide; With iron(III) chloride; potassium borohydride; In tetrahydrofuran; at 20 ℃; Reflux;

With hydrogenchloride; In tetrahydrofuran; for 1h; Reagent/catalyst; Solvent;

Reference yield:

C19H29NO5 → N-Methyltyramine hydrochloride (13062-76-5)

Guidance literature:

C₁₉H₂₉NO₅; With trifluoroacetic acid; In dichloromethane;

With hydrogenchloride; In methanol; diethyl ether; regioselective reaction;

DOI:10.1021/jacs.9b01077

upstream raw materials:

N-t-butoxycarbonyl-tyramine

2-(4-hydroxyphenyl)-N-methylacetamide

N-methyl-N-(2-[4-hydroxyphenyl]ethyl)amine hydrobromide

N-methyltyramine

Downstream raw materials:

N-(p-hydroxyphenethyl)-3-(methylsulfonyl)propenamide

N-tert-butoxycarbonyl-N-methyl-2-(4-hydroxyphenyl)-ethylamine

Refernces

• 1、 -. "Preparation method of N-methyltyramine hydrochloride". Paragraph 0039; 0050-0061. . Retrieved 2021/11/26.
• 2、 -. "Synthesis method of N-methyltyramine hydrochloride". Paragraph 0028; 0030; 0031; 0033; 0034; 0036; 0037; 0039. . Retrieved 2017/08/29.