4-(bromomethyl)naphthalene-1-carboxylic Acid

Base Information

• Chemical Name: 4-(bromomethyl)naphthalene-1-carboxylic Acid
• CAS No.: 30236-02-3
• Molecular Formula: C₁₂H₉BrO₂
• Molecular Weight: 265.106
• Hs Code.: 2916399090
• DSSTox Substance ID: DTXSID30450574
• Wikidata: Q82270360
• Mol file: 30236-02-3.mol

Synonyms:30236-02-3;4-(bromomethyl)naphthalene-1-carboxylic Acid;4-(Bromomethyl)-1-naphthoic acid;4-BROMOMETHYL-NAPHTHALENE-1-CARBOXYLIC ACID;4-Bromomethylnaphthoic Acid;SCHEMBL926511;4-(Bromomethyl)-1-naphthoicacid;DTXSID30450574;FPUUDRJMMXKEMP-UHFFFAOYSA-N;AB1255;MFCD00228229;AKOS022666332;SB36472;4-(bromomethyl)naphthalen-1-carboxylic acid;1-(Bromomethyl)naphthalene-4-carboxylic acid;4-(bromomethyl)-1-naphthalenecarboxylic acid;FT-0766545;EN300-256346;A820272

Chemical Property of 4-(bromomethyl)naphthalene-1-carboxylic Acid

Chemical Property:

• PSA: 37.30000
• LogP: 3.43290
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 263.97859
• Heavy Atom Count: 15
• Complexity: 242

Purity/Quality:

98%Min ^*data from raw suppliers

4-(Bromomethyl)naphthalene-1-carboxylicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(=CC=C2C(=O)O)CBr

Technology Process of 4-(bromomethyl)naphthalene-1-carboxylic Acid

There total 8 articles about 4-(bromomethyl)naphthalene-1-carboxylic 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: 100.0%

4-methoxymethyl-1-naphthoic acid (79996-84-2) → 4-(bromomethyl)-naphthalene-1-carboxylic acid (30236-02-3)

Guidance literature:

With hydrogen bromide; In benzene; 1.) room temperature, 12 h; 2.) 75 deg C, 3 h; 3.) room temperature, 6 h;

Reference yield: 88.5%

4-Methyl-1-naphthoic acid (4488-40-8) → 4-(bromomethyl)-naphthalene-1-carboxylic acid (30236-02-3)

Guidance literature:

With 1,3-dibromo-5,5-dimethylimidazolidine-2,4-dione; In acetonitrile; at 50 - 60 ℃; for 3h; Reagent/catalyst;

Reference yield:

→ 4-(bromomethyl)-naphthalene-1-carboxylic acid (30236-02-3)

Guidance literature:

With N-Bromosuccinimide; Perbenzoic acid; In tetrachloromethane; for 3h; Heating; Irradiation;

upstream raw materials:

4-methoxymethyl-1-naphthoic acid

4-Methyl-1-naphthoic acid

1-acetyl-4-methylnaphthalene

1-Methylnaphthalene

Downstream raw materials:

4-formylnaphthalene-1-carboxylic acid

methyl 4-bromomethylnaphthalene-1-carboxylate

Refernces

• 1、 Boldrini, Cosimo,Harutyunyan, Syuzanna R.. "Pd-catalyzed allylative dearomatisation using Grignard reagents". supporting information. p. 11807 - 11810. Retrieved 2021/11/30.
• 2、 -. "ISOINDOLE DERIVATIVES USEFUL FOR TREATING PAIN, GASTROINTESTINAL DISEASES AND CANCER". Page/Page column 43-44. . Retrieved 2008/06/13.