1-(Tert-butylamino)-3-phenoxypropan-2-ol

Base Information

• Chemical Name: 1-(Tert-butylamino)-3-phenoxypropan-2-ol
• CAS No.: 64980-40-1
• Molecular Formula: C13H21NO2
• Molecular Weight: 223.315
• DSSTox Substance ID: DTXSID10874496
• Nikkaji Number: J967.591D
• ChEMBL ID: CHEMBL180767

Synonyms:1-(tert-butylamino)-3-phenoxypropan-2-ol;64980-40-1;CHEMBL180767;1-tert-Butylamino-3-phenoxy-propan-2-ol;Oprea1_252607;Oprea1_725989;SCHEMBL22957897;DTXSID10874496;phenoxy-3-t-butylamino-propan-2-ol;BBL000716;BDBM50169816;STK279829;AKOS000531115;AKOS016072304;CCG-115676;VS-00681;1-(tert-Butylamino)-3-phenoxy-2-propanol;CS-0322720;EU-0049567;AB00979801-01;SR-01000311819;SR-01000311819-1;2-PROPANOL, 1-[(1,1-DIMETHYLETHYL)AMINO]-3-PHENO

Chemical Property of 1-(Tert-butylamino)-3-phenoxypropan-2-ol

Chemical Property:

• XLogP3: 1.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 223.157228913
• Heavy Atom Count: 16
• Complexity: 183

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)(C)NCC(COC1=CC=CC=C1)O

Technology Process of 1-(Tert-butylamino)-3-phenoxypropan-2-ol

There total 17 articles about 1-(Tert-butylamino)-3-phenoxypropan-2-ol 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%

Phenyl glycidyl ether (122-60-1,71031-02-2) + tert-butylamine (75-64-9) → 1-(N-tert-butyl)amino-3-phenoxy-2-propanol (64980-40-1)

Guidance literature:

In 2,2,2-trifluoroethanol; at 20 ℃; for 6h; regioselective reaction;

DOI:10.1016/j.jfluchem.2009.10.003

Reference yield: 84.0%

Phenyl glycidyl ether (122-60-1,71031-02-2) + tert-butylamine (75-64-9) → 1-(N-tert-butyl)amino-3-phenoxy-2-propanol (64980-40-1) + 3,3'-(tert-butylazanediyl)bis(1-phenoxypropan-2-ol) (121196-97-2)

Guidance literature:

In ethanol; at 195 ℃; for 0.0166667h; under 12929 Torr; Product distribution / selectivity;

Reference yield: 28.0%

tert-butylamine (75-64-9) + 2-Chloro-2-fluoro-3-phenoxymethyl-oxirane → 1-(N-tert-butyl)amino-3-phenoxy-2-propanol (64980-40-1) + (Z)-1,4-di(phenoxy)but-2-ene (52752-55-3) + (E)-1,4-diphenoxybut-2-ene (15779-52-9)

Guidance literature:

In tetrahydrofuran;

DOI:10.1016/S0040-4039(97)00804-6

upstream raw materials:

vinyl phenyl ether

trioxo(N-tert-butylimido)osmium(VIII)

Phenyl glycidyl ether

tert-butylamine

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