Tert-butyl 4-hydroxyphenethylcarbamate

Base Information

• Chemical Name: Tert-butyl 4-hydroxyphenethylcarbamate
• CAS No.: 64318-28-1
• Molecular Formula: C13H19NO3
• Molecular Weight: 237.299
• Hs Code.: 2924299090
• European Community (EC) Number: 627-786-3
• DSSTox Substance ID: DTXSID60474147
• Nikkaji Number: J1.157.723G
• Wikidata: Q72450968
• Mol file: 64318-28-1.mol

Synonyms:64318-28-1;N-Boc-tyramine;Boc-Tyramine;tert-butyl 4-hydroxyphenethylcarbamate;Tert-butyl N-[2-(4-hydroxyphenyl)ethyl]carbamate;N-Boc-2-(4-Hydroxyphenyl)ethylamine;N-(tert-Butoxycarbonyl)tyramine;[2-(4-Hydroxyphenyl)ethyl]carbamic acid tert-butyl ester;N-tert-Butoxycarbonyl Tyramine;MFCD05864730;t-Butyl [2-(4-hydroxyphenyl)ethyl]carbamate;N-Boc tyramine;N-Boc-tyramine, 97%;N-t-butoxycarbonyltyramine;Carbamic acid, [2-(4-hydroxyphenyl)ethyl]-, 1,1-dimethylethyl ester;N-t-butoxycarbonyl tyramine;N-Boc-4-hydroxyphenethylamine;SCHEMBL100146;N-tertiary butoxycarbonyltyramine;DTXSID60474147;ILNOTKMMDBWGOK-UHFFFAOYSA-N;t-butyl [4-hydroxyphenethyl]carbamate;AKOS005216662;CS-W012850;GS-4218;SY047807;A8820;AM20060704;B3512;FT-0630013;tert-Butyl 2-(4-hydroxyphenyl)ethylcarbamate;(E)-3-(2,5-Dimethoxyphenyl)acryloylchloride;EN300-89201;tert-butyl[2-(4-hydroxyphenyl)ethyl]carbamate;N-(tert-Butoxycarbonyl)-4-hydroxyphenethylamine;tert-Butyl [2-(4-hydroxyphenyl)ethyl]carbamate;tert-butyl[2-(4-hydroxyphenyl)-ethyl]carbamate;N-(t-butoxycarbonyl)-2-(4-hydroxyphenyl)ethylamine;2-(4-hydroxyphenyl)ethylcarbamic acid, t-butyl ester;N-(t-butoxycarbonyl)-2-(4-hydroxyphenyl)-ethylamine;N-t-Butoxycarbonyl-2-[(4-hydroxy-phenyl)]-ethylamine;[2-(4-Hydroxy-phenyl)-ethyl]carbamic acid tert-butyl ester;[2-(4-hydroxy-phenyl)ethyl]-carbamic acid tert-butyl ester;[2-(4-hydroxyphenyl)-ethyl]-carbamic acid tert-butyl ester;[2-(4-hydroxy-phenyl)-ethyl]-carbamic acid tert butyl ester;[2-(4-hydroxy-phenyl)-ethyl]-carbamic acid tert-butyl ester

Chemical Property of Tert-butyl 4-hydroxyphenethylcarbamate

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 71-75 °C
• Refractive Index: 1.526
• Boiling Point: 395.704 °C at 760 mmHg
• PKA: 10.01±0.15(Predicted)
• Flash Point: 193.115 °C
• PSA: 58.56000
• Density: 1.101 g/cm³
• LogP: 2.85030
• Storage Temp.: Keep in dark place,Sealed in dry,Room Temperature
• Solubility.: Chloroform (Slightly), Methanol (Slightly)
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 237.13649347
• Heavy Atom Count: 17
• Complexity: 240

Purity/Quality:

98%,99%, ^*data from raw suppliers

N-tert-Butoxycarbonyl tyramine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)NCCC1=CC=C(C=C1)O
• Uses: Intermediate in the preparation of Thyroxin derivatives.

Technology Process of Tert-butyl 4-hydroxyphenethylcarbamate

There total 13 articles about Tert-butyl 4-hydroxyphenethylcarbamate 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: 100.0%

di-tert-butyl dicarbonate (24424-99-5) + tyramine hydrochloride (60-19-5) → N-t-butoxycarbonyl-tyramine (64318-28-1)

Guidance literature:

With sodium hydrogencarbonate; In tetrahydrofuran; water; at 20 ℃;

DOI:10.1016/j.bmcl.2021.128165

Reference yield: 100.0%

tyrosamine (51-67-2) + di-tert-butyl dicarbonate (24424-99-5) → N-t-butoxycarbonyl-tyramine (64318-28-1)

Guidance literature:

With triethylamine; In tetrahydrofuran; methanol; at 0 - 20 ℃;

Reference yield: 98.0%

tert-butyldicarbonate (34619-03-9) + tyramine hydrochloride (60-19-5) → N-t-butoxycarbonyl-tyramine (64318-28-1)

Guidance literature:

With triethylamine; In 1,4-dioxane; water; at 20 ℃; for 3h;

DOI:10.1021/jo1019317

upstream raw materials:

tyrosamine

di-tert-butyl dicarbonate

tyramine hydrochloride

N-(tert-butoxycarbonyl)-2-[4-(benzyloxy)phenyl]ethylamine

Downstream raw materials:

{4-[2-methyl-1-(2-oxo-oxazolidin-4-yl)-propoxy]-phenethyl}-carbamic acid tert-butyl ester

(E)-3-{3-[4-(2-tert-Butoxycarbonylamino-ethyl)-phenoxy]-phenyl}-acrylic acid methyl ester

Methyl 3-ethyl>phenoxy>-1-pyrroline-2-carboxylate

Boc-NH-CH₂CH₂C₆H₄-4-OTBS

Refernces

• 1、 Park, G. Kate,Lee, Jeong Heon,Levitz, Andrew,El Fakhri, Georges,Hwang, Nathaniel S.,Henary, Maged,Choi, Hak Soo. "Lysosome-Targeted Bioprobes for Sequential Cell Tracking from Macroscopic to Microscopic Scales". . . Retrieved 2019.
• 2、 Bisyris, Evangelos,Kordopati, Golfo G.,Magriotis, Plato A.,Matsoukas, Minos,Pampalakis, Georgios,Sotiropoulou, Georgia,Zingkou, Eleni. "Generation of a quenched phosphonate activity-based probe for labelling the active KLK7 protease". supporting information. p. 6834 - 6841. Retrieved 2021/08/20.
• 3、 -. "6-amino-4-(4-phenoxyphenylethylamino)quinazoline derivative as well as preparation method and application thereof". Paragraph 0036-0038. . Retrieved 2021/01/24.