1,10-Phenanthroline-2-carbonyl chloride

Base Information

• Chemical Name: 1,10-Phenanthroline-2-carbonyl chloride
• CAS No.: 57154-80-0
• Molecular Formula: C13H7ClN2O
• Molecular Weight: 242.664
• DSSTox Substance ID: DTXSID40551546
• Nikkaji Number: J1.520.583K
• Wikidata: Q82431260
• Mol file: 57154-80-0.mol

Synonyms:1,10-Phenanthroline-2-carbonyl chloride;57154-80-0;SCHEMBL4765306;DTXSID40551546

Chemical Property of 1,10-Phenanthroline-2-carbonyl chloride

Chemical Property:

• PSA: 42.85000
• LogP: 3.16200
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 242.0246905
• Heavy Atom Count: 17
• Complexity: 310

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC2=C(C3=C(C=C2)C=CC(=N3)C(=O)Cl)N=C1

Technology Process of 1,10-Phenanthroline-2-carbonyl chloride

There total 7 articles about 1,10-Phenanthroline-2-carbonyl chloride 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:

1,10-phenanthroline-2-carboxylic acid (1891-17-4) → 1,10-phenanthroline-2-carboxylic acid chloride (57154-80-0)

Guidance literature:

With thionyl chloride; for 6h; Heating;

DOI:10.1002/jhet.5570370125

Reference yield:

1,10-Phenanthroline (66-71-7) → 1,10-phenanthroline-2-carboxylic acid chloride (57154-80-0)

Guidance literature:

Multi-step reaction with 4 steps

1: dihydrogen peroxide; acetic acid / water / 6 h / 70 °C

2: benzoyl chloride / water / 1 h / 20 °C

3: water; sodium hydroxide / ethanol / Reflux

4: thionyl chloride / 0.5 h / Reflux

With thionyl chloride; water; dihydrogen peroxide; benzoyl chloride; acetic acid; sodium hydroxide; In ethanol; water;

DOI:10.1039/c3dt50941a

Reference yield:

1,10-phenanthroline N-oxide (1891-19-6) → 1,10-phenanthroline-2-carboxylic acid chloride (57154-80-0)

Guidance literature:

Multi-step reaction with 3 steps

1: benzoyl chloride / water / 1 h / 20 °C

2: water; sodium hydroxide / ethanol / Reflux

3: thionyl chloride / 0.5 h / Reflux

With thionyl chloride; water; benzoyl chloride; sodium hydroxide; In ethanol; water;

DOI:10.1039/c3dt50941a

upstream raw materials:

1,10-phenanthroline-2-carboxylic acid

1,10-Phenanthroline

1,10-phenanthroline N-oxide

1,10-phenanthroline-2-carbonitrile

Downstream raw materials:

4-hydroxyphenyl-1,10-phenanthroline-2-carboxamide

1-[N-(1,10-phenanthrolin-2-ylcarbonyl)aminomethyl]-3,5-bis[(4,6-dimethylpyridin-2-yl)aminomethyl]-2,4,6-triethylbenzene

1,10-phenanthroline-2-carboxamide-phenyl-4-ethoxypiperidine palladium(II) chloride

1,10-phenanthroline-2-carboxamide-phenyl-4-ethoxypiperidine platinum(II) chloride

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