6-Phenyl-1,3-dihydro-indol-2-one

Base Information

• Chemical Name: 6-Phenyl-1,3-dihydro-indol-2-one
• CAS No.: 90751-00-1
• Molecular Formula: C14H11 N O
• Molecular Weight: 209.247
• DSSTox Substance ID: DTXSID40441413
• Nikkaji Number: J2.362.634I
• Wikidata: Q82258176
• Mol file: 90751-00-1.mol

Synonyms:6-PHENYL-1,3-DIHYDRO-INDOL-2-ONE;90751-00-1;6-phenyl-1,3-dihydroindol-2-one;6-PHENYLINDOLIN-2-ONE;6-phenyl-2-indolinone;6-phenyl-1,3-dihydro-2H-indol-2-one;6-phenyl-oxindole;6-phenyl-2-oxindole;6-PHENYLOXINDOLE;6-Phenylindoline-2-one;SCHEMBL4408889;DTXSID40441413;BRTXRFCARXOWJV-UHFFFAOYSA-N;BDBM588279;US11542274, Compound 001;MB03895

Chemical Property of 6-Phenyl-1,3-dihydro-indol-2-one

Chemical Property:

• PSA: 32.59000
• LogP: 2.93330
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 209.084063974
• Heavy Atom Count: 16
• Complexity: 270

Purity/Quality:

98% ^*data from raw suppliers

6-phenyl-1,3-dihydro-indol-2-one 95 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C2=C(C=C(C=C2)C3=CC=CC=C3)NC1=O

Technology Process of 6-Phenyl-1,3-dihydro-indol-2-one

There total 13 articles about 6-Phenyl-1,3-dihydro-indol-2-one 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: 93.0%

2-nitro-4-phenylbenzeneacetic acid (80726-56-3) → 6-phenyl-2-oxindole (90751-00-1)

Guidance literature:

With iron; acetic acid; for 2h; Heating;

DOI:10.1021/jm9904295

Reference yield: 93.0%

2-nitro-4-phenylbenzeneacetic acid (80726-56-3) + iron (7439-89-6) + malonic acid dimethyl ester (108-59-8) + 4-Fluoro-3-nitrobiphenyl (206879-57-4) + dimethyl 3-nitrobiphenyl-4-malonate (100487-83-0) → 6-phenyl-2-oxindole (90751-00-1)

Guidance literature:

In hydrogenchloride; acetic acid; dimethyl sulfoxide; ethyl acetate;

Reference yield: 93.0%

2-nitro-4-phenylbenzeneacetic acid (80726-56-3) → 6-phenyl-2-oxindole (90751-00-1) + SU 16f (251356-45-3)

Guidance literature:

In acetic acid; ethyl acetate;

upstream raw materials:

2-nitro-4-phenylbenzeneacetic acid

4-Bromo-1-fluoro-2-nitrobenzene

4-Fluoro-3-nitrobiphenyl

dimethyl 3-nitrobiphenyl-4-malonate

Downstream raw materials:

1-(2-Oxo-6-phenyl-1,2-dihydro-indol-3-ylidenemethyl)-2,5,6,7-tetrahydro-pyrrolo [3,4-c]pyridin-4-one

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