4-Dodecyloxybenzoyl chloride

Base Information

• Chemical Name: 4-Dodecyloxybenzoyl chloride
• CAS No.: 50909-50-7
• Molecular Formula: C19H29 Cl O2
• Molecular Weight: 324.891
• Hs Code.: 2918990090
• DSSTox Substance ID: DTXSID40508030
• Nikkaji Number: J2.375.423A
• Wikidata: Q72470426
• Mol file: 50909-50-7.mol

Synonyms:4-Dodecyloxybenzoyl chloride;4-dodecoxybenzoyl chloride;50909-50-7;p-n-dodecyloxybenzoyl chloride;SCHEMBL2387345;p-dodecyloxybenzoic acid chloride;DTXSID40508030;QTCIJWYCQZVLNL-UHFFFAOYSA-N;p-n-dodecyloxybenzoic acid chloride;4-(DODECYLOXY)BENZOYL CHLORIDE;AKOS015890233;FT-0658673;A828358

Chemical Property of 4-Dodecyloxybenzoyl chloride

Chemical Property:

• Vapor Pressure: 1.94E-07mmHg at 25°C
• Boiling Point: 425.2°C at 760 mmHg
• Flash Point: 154.9°C
• PSA: 26.30000
• Density: 1.01g/cm³
• LogP: 6.36530
• XLogP3: 8.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 13
• Exact Mass: 324.1856079
• Heavy Atom Count: 22
• Complexity: 273

Purity/Quality:

99% ^*data from raw suppliers

4-DODECYLOXYBENZOYL CHLORIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)Cl

Technology Process of 4-Dodecyloxybenzoyl chloride

There total 12 articles about 4-Dodecyloxybenzoyl 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:

p-dodecyloxybenzoic acid (2312-15-4) → 4-dodecyloxybenzoyl chloride (50909-50-7)

Guidance literature:

With phosphorus pentachloride;

DOI:10.1021/ja01259a062

Reference yield:

1-dodecylbromide (143-15-7) → 4-dodecyloxybenzoyl chloride (50909-50-7)

Guidance literature:

Multi-step reaction with 2 steps

1: KOH / ethanol / Heating

2: SOCl₂

With potassium hydroxide; thionyl chloride; In ethanol;

DOI:10.1080/10587250108025027

Reference yield:

4-hydroxy-benzoic acid (99-96-7) → 4-dodecyloxybenzoyl chloride (50909-50-7)

Guidance literature:

Multi-step reaction with 2 steps

1: KOH / ethanol / Heating

2: SOCl₂

With potassium hydroxide; thionyl chloride; In ethanol;

DOI:10.1080/10587250108025027

upstream raw materials:

p-dodecyloxybenzoic acid

1-dodecylbromide

4-hydroxy-benzoic acid

methyl 4-(dodecyloxy)benzoate

Downstream raw materials:

1,4,7,10,13,16-hexakis(4-(dodecyloxy)benzoyl)-1,4,7,10,13,16-hexaazacyclooctadecane

4-Dodecyloxy-benzoic acid p-tolyl ester

4(4-Dodecyloxybenzoyloxy)-4'-cyanoazobenzol

bis p,p'-(p''-n-dodecyloxy benzanilide)-o-dianisidine