2-Acetamidophenanthrene

Base Information

• Chemical Name: 2-Acetamidophenanthrene
• CAS No.: 4120-77-8
• Molecular Formula: C₁₆H₁₃NO
• Molecular Weight: 235.285
• Hs Code.: 2924299090
• NSC Number: 141592
• DSSTox Substance ID: DTXSID70194122
• Nikkaji Number: J2.207A
• Wikidata: Q83066876
• ChEMBL ID: CHEMBL313966
• Mol file: 4120-77-8.mol

Synonyms:2-acetamidophenanthrene;2-acetylaminophenanthrene

Chemical Property of 2-Acetamidophenanthrene

Chemical Property:

• Vapor Pressure: 2.12E-10mmHg at 25°C
• Refractive Index: 1.6000 (estimate)
• Boiling Point: 506.9°Cat760mmHg
• Flash Point: 302.8°C
• PSA: 29.10000
• Density: 1.233g/cm³
• LogP: 4.02440
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 235.099714038
• Heavy Atom Count: 18
• Complexity: 314

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NC1=CC2=C(C=C1)C3=CC=CC=C3C=C2

Technology Process of 2-Acetamidophenanthrene

There total 6 articles about 2-Acetamidophenanthrene 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:

→ N-[2]phenanthryl-acetamide (4120-77-8)

Guidance literature:

With hydrogenchloride; acetic anhydride; acetic acid; anschliessendes Erwaermen;

DOI:10.1021/jo01221a005

Reference yield:

phenanthren-2-ol (605-55-0) + sodium acetate (127-09-3) → N-[2]phenanthryl-acetamide (4120-77-8)

Guidance literature:

With ammonium chloride; acetic acid; at 280 - 300 ℃;

DOI:10.1111/1467-954X.00203

Reference yield:

1-[2]phenanthryl-ethanone oxime (5960-77-0) → N-[2]phenanthryl-acetamide (4120-77-8)

Guidance literature:

With phosphorus pentachloride;

upstream raw materials:

phenanthren-2-ol

sodium acetate

1-[2]phenanthryl-ethanone oxime

acetic anhydride

Downstream raw materials:

2-aminophenanthrene