Boronic acid, [(S)-(acetylamino)phenylmethyl]-

Base Information

Chemical Name:Boronic acid, [(S)-(acetylamino)phenylmethyl]-
CAS No.:641620-70-4
Molecular Formula:C9H12BNO3
Molecular Weight:193.01
Hs Code.:
DSSTox Substance ID:DTXSID80468866
Nikkaji Number:J1.996.530I
Wikidata:Q82296318

Synonyms:641620-70-4;(S)-(Acetamido(phenyl)methyl)boronic acid;[(S)-acetamido(phenyl)methyl]boronic acid;Boronic acid, [(S)-(acetylamino)phenylmethyl]-;starbld0019221;DTXSID80468866

Suppliers and Price of Boronic acid, [(S)-(acetylamino)phenylmethyl]-

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

Total 1 raw suppliers

Chemical Property of Boronic acid, [(S)-(acetylamino)phenylmethyl]-

Chemical Property:

Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:193.0910234
Heavy Atom Count:14
Complexity:193

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:B(C(C1=CC=CC=C1)NC(=O)C)(O)O
Isomeric SMILES:B([C@@H](C1=CC=CC=C1)NC(=O)C)(O)O

Technology Process of Boronic acid, [(S)-(acetylamino)phenylmethyl]-

There total 5 articles about Boronic acid, [(S)-(acetylamino)phenylmethyl]- 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: 95.0%

: N-[(S)-Phenyl-((1R,2R,6S,8R)-2,9,9-trimethyl-3,5-dioxa-4-bora-tricyclo[6.1.1.0^2,6]dec-4-yl)-methyl]-acetamide

: 641620-70-4
C₉H₁₂BNO₃

Guidance literature:: With hydrogenchloride; for 1h; Heating;
DOI:10.1021/ol0359970

Reference yield:

: phenylboronic acid (1R,2R,3S,5R)-(-)-2,3-pinanediol ester

: 641620-70-4
C₉H₁₂BNO₃

Guidance literature:: Multi-step reaction with 3 steps

1.1: n-BuLi / tetrahydrofuran; hexane / 0.5 h / -100 °C

1.2: tetrahydrofuran; hexane / -100 - 20 °C

2.1: lithium bis(trimethylsilyl)amide / tetrahydrofuran; hexane / -78 - 20 °C

2.2: 1.3 g / acetic acid / tetrahydrofuran; hexane / -78 - 20 °C

3.1: 95 percent / aq. HCl / 1 h / Heating

With hydrogenchloride; n-butyllithium; lithium hexamethyldisilazane; In tetrahydrofuran; hexane; 1.2: Matteson homologation reaction;
DOI:10.1021/ol0359970

Reference yield:

: (R)-(chloro(phenyl)methyl)boronic acid boronic acid (1R,2R,3S,5R)-(-)-2,3-pinanediol ester

: 641620-70-4
C₉H₁₂BNO₃

Guidance literature:: Multi-step reaction with 2 steps

1.1: lithium bis(trimethylsilyl)amide / tetrahydrofuran; hexane / -78 - 20 °C

1.2: 1.3 g / acetic acid / tetrahydrofuran; hexane / -78 - 20 °C

2.1: 95 percent / aq. HCl / 1 h / Heating

With hydrogenchloride; lithium hexamethyldisilazane; In tetrahydrofuran; hexane;
DOI:10.1021/ol0359970