3-tert-Butoxy-2-hydroxy-3-oxo-1-phenylpropan-1-aminium

Base Information

Chemical Name:3-tert-Butoxy-2-hydroxy-3-oxo-1-phenylpropan-1-aminium
CAS No.:135981-02-1
Molecular Formula:C13H19 N O3
Molecular Weight:237.299
Hs Code.:
DSSTox Substance ID:DTXSID00929202
Wikidata:Q82904037
Mol file:135981-02-1.mol

Synonyms:DTXSID00929202;3-tert-Butoxy-2-hydroxy-3-oxo-1-phenylpropan-1-aminium

Suppliers and Price of 3-tert-Butoxy-2-hydroxy-3-oxo-1-phenylpropan-1-aminium

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

American Custom Chemicals Corporation
T-BUTYL (2R,3R)-3-AMINO-2-HYDROXY-3-PHENYLPROPANOATE 95.00%
100MG
$ 1571.85

American Custom Chemicals Corporation
T-BUTYL (2R,3R)-3-AMINO-2-HYDROXY-3-PHENYLPROPANOATE 95.00%
5MG
$ 498.92

Total 9 raw suppliers

Chemical Property of 3-tert-Butoxy-2-hydroxy-3-oxo-1-phenylpropan-1-aminium

Chemical Property:

Vapor Pressure:4.43E-06mmHg at 25°C
Boiling Point:368.5 °C at 760 mmHg
Flash Point:176.7 °C
PSA：72.55000
Density:1.126 g/cm³
LogP:2.08930
XLogP3:1.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:238.14431850
Heavy Atom Count:17
Complexity:254

Purity/Quality:

99% ^*data from raw suppliers

T-BUTYL (2R,3R)-3-AMINO-2-HYDROXY-3-PHENYLPROPANOATE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)OC(=O)C(C(C1=CC=CC=C1)[NH3+])O
Isomeric SMILES:CC(C)(C)OC(=O)[C@@H]([C@@H](C1=CC=CC=C1)[NH3+])O

Technology Process of 3-tert-Butoxy-2-hydroxy-3-oxo-1-phenylpropan-1-aminium

There total 9 articles about 3-tert-Butoxy-2-hydroxy-3-oxo-1-phenylpropan-1-aminium 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%

: 151671-03-3
tert-butyl (2R,3R,αR)-3--2-hydroxy-3-phenylpropionate

: 135981-02-1,204587-97-3
tert-butyl (2R,3R)-3-amino-2-hydroxy-3-phenylpropionate

Guidance literature:: With 10 wt% Pd(OH)2 on carbon; hydrogen; In methanol; at 20 ℃; for 15h; under 3800.26 Torr;
DOI:10.1016/j.tet.2013.08.007

Reference yield: 88.0%

: 136031-73-7
(2R,3R)-3-Azido-2-hydroxy-3-phenyl-propionic acid tert-butyl ester

: 135981-02-1,204587-97-3
tert-butyl (2R,3R)-3-amino-2-hydroxy-3-phenylpropionate

Guidance literature:: With hydrogen; palladium on activated charcoal; In tetrahydrofuran; at 20 ℃; for 20h; under 760 Torr;
DOI:10.1016/0040-4039(91)80631-F

Reference yield:

: 14990-09-1
tert-butyl cinnamate

: 135981-02-1,204587-97-3
tert-butyl (2R,3R)-3-amino-2-hydroxy-3-phenylpropionate

Guidance literature:: Multi-step reaction with 2 steps

1: 2.) (+)-(camphorsulfonyl)oxaziridine / 1) THF, -78 deg C, 2 h; 2) THF, -78 deg C (1 h), -78 --> 0 deg C (15 min)

2: 99 percent / H₂ / Pd-C / acetic acid / 5320 Torr / Ambient temperature

With (+)-(2S,8aS)-(camphorylsulfonyl)oxaziridine; hydrogen; palladium on activated charcoal; In acetic acid;