3-(3-Nitrophenyl)-2-oxopropanoic acid

Base Information

Chemical Name:3-(3-Nitrophenyl)-2-oxopropanoic acid
CAS No.:38712-57-1
Molecular Formula:C9H7NO5
Molecular Weight:209.158
Hs Code.:
DSSTox Substance ID:DTXSID201298147

Synonyms:3-(3-NITROPHENYL)-2-OXOPROPANOIC ACID;38712-57-1;SCHEMBL1694325;DTXSID201298147;MFCD01138527;AKOS000142741;SY338839;EN300-1851723

Suppliers and Price of 3-(3-Nitrophenyl)-2-oxopropanoic acid

Supply Marketing:

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

Manufacturers and distributors:

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Total 0 raw suppliers

Chemical Property of 3-(3-Nitrophenyl)-2-oxopropanoic acid

Chemical Property:

XLogP3:1.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:209.03242232
Heavy Atom Count:15
Complexity:283

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC(=C1)[N+](=O)[O-])CC(=O)C(=O)O

Technology Process of 3-(3-Nitrophenyl)-2-oxopropanoic acid

There total 9 articles about 3-(3-Nitrophenyl)-2-oxopropanoic acid 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: 72.0%

: 57731-07-4
2-methyl-4-(3-nitrobenzylidene)-2-methyloxazol-5(4H)-one

: 38712-57-1
3-(3-nitro-phenyl)-2-oxo-propionic acid

Guidance literature:: With hydrogenchloride; water; Reflux;
DOI:10.1021/jm2016182

Reference yield:

: (2RS,3SR)-2,3-dihydroxy-3-(3-nitro-phenyl)-propionic acid methyl ester

: 38712-57-1
3-(3-nitro-phenyl)-2-oxo-propionic acid

Guidance literature:: With sulfuric acid;

Reference yield:

: 555-68-0,1772-76-5
m-Nitrocinnamic Acid

: 38712-57-1
3-(3-nitro-phenyl)-2-oxo-propionic acid

Guidance literature:: Multi-step reaction with 3 steps

1: borane-ammonia complex; ammonium hydroxide / aq. buffer / 37 °C / pH 9.6 / Enzymatic reaction

2: oxygen / Enzymatic reaction

3: water

With ammonium hydroxide; borane-ammonia complex; water; oxygen; In aq. buffer;
DOI:10.1002/anie.201410670