4-(2-Anthryl)butanoic acid

Base Information

• Chemical Name: 4-(2-Anthryl)butanoic acid
• CAS No.: 73693-25-1
• Molecular Formula: C18H16 O2
• Molecular Weight: 264.324
• NSC Number: 409080
• DSSTox Substance ID: DTXSID10223985
• Wikidata: Q83102497
• Mol file: 73693-25-1.mol

Synonyms:4-(2-anthryl)butanoic acid;4-ABA

Chemical Property of 4-(2-Anthryl)butanoic acid

Chemical Property:

• Vapor Pressure: 2.63E-10mmHg at 25°C
• Boiling Point: 487.2°C at 760 mmHg
• Flash Point: 383.7°C
• PSA: 37.30000
• Density: 1.211g/cm³
• LogP: 4.40030
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 264.115029749
• Heavy Atom Count: 20
• Complexity: 338

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C=C3C=C(C=CC3=CC2=C1)CCCC(=O)O

Technology Process of 4-(2-Anthryl)butanoic acid

There total 6 articles about 4-(2-Anthryl)butanoic 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:

4-(9-hydroxy-[2]anthryl)-butyric acid → 4-(2-Anthryl)-1-butanoic acid (73693-25-1)

Guidance literature:

With ammonium hydroxide; zinc;

DOI:10.1021/ja01854a010

Reference yield:

3-(9,10-dihydro-2-anthroyl)propionic acid (936928-63-1) → 4-(9,10-dihydro-2-anthryl)butanoic acid (936928-65-3) + 4-(2-Anthryl)-1-butanoic acid (73693-25-1)

Guidance literature:

With potassium hydroxide; hydrazine hydrate; In diethylene glycol; at 200 ℃; for 8h;

DOI:10.1039/b700001d

Reference yield:

9,10-dihydroanthracene (613-31-0) → 4-(2-Anthryl)-1-butanoic acid (73693-25-1)

Guidance literature:

Multi-step reaction with 2 steps

1: aluminum chloride / 1,2-dichloro-ethane / 2 h / 20 °C

2: hydrazine monohydrate; potassium hydroxide / bis-(2-hydroxy-ethyl) ether / 8 h / 200 °C

With potassium hydroxide; aluminium trichloride; hydrazine hydrate; In 1,2-dichloro-ethane; diethylene glycol;

DOI:10.1039/b700001d

upstream raw materials:

3-(2-anthroyl)propionic acid

3-(9,10-dihydro-2-anthroyl)propionic acid

9,10-dihydroanthracene

anthracene

Downstream raw materials:

3,4-dihydrobenzanthracen-1(2H)-one

Refernces