1,2-Dibutoxybenzene

Base Information

• Chemical Name: 1,2-Dibutoxybenzene
• CAS No.: 20367-35-5
• Molecular Formula: C14H22O2
• Molecular Weight: 222.327
• European Community (EC) Number: 606-538-8
• DSSTox Substance ID: DTXSID901026616
• Nikkaji Number: J141.469K
• ChEMBL ID: CHEMBL2252468
• Mol file: 20367-35-5.mol

Synonyms:1,2-Dibutoxybenzene;20367-35-5;Benzene, 1,2-dibutoxy-;o-Dibutoxybenzene;1,2-dibutyloxybenzene;1,2-Dibutoxybenzene #;SCHEMBL1226749;CHEMBL2252468;DTXSID901026616;AKOS021983746

Chemical Property of 1,2-Dibutoxybenzene

Chemical Property:

• Vapor Pressure: 0.0269mmHg at 25°C
• Boiling Point: 155 - 161 °C (16 mmHg)
• PSA: 18.46000
• LogP: 4.04440
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 8
• Exact Mass: 222.161979940
• Heavy Atom Count: 16
• Complexity: 141

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCOC1=CC=CC=C1OCCCC

Technology Process of 1,2-Dibutoxybenzene

There total 10 articles about 1,2-Dibutoxybenzene 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: 95.0%

1-bromo-butane (109-65-9) + benzene-1,2-diol (120-80-9,19481-10-8,37349-32-9) → 1,2-dibutoxybenzene (20367-35-5)

Guidance literature:

With potassium carbonate; In acetone;

DOI:10.1016/0040-4039(95)01562-V

Reference yield: 92.0%

1-iodo-butane (542-69-8) + benzene-1,2-diol (120-80-9,19481-10-8,37349-32-9) → 1,2-dibutoxybenzene (20367-35-5)

Guidance literature:

With potassium carbonate; In acetone; for 48h; Reflux;

DOI:10.1021/jo302135q

Reference yield: 35.0%

1,2-dimethoxybenzene (91-16-7) + 1-n-butyl-3-methylimidazolim bromide (85100-77-2) → 1,2-dibutoxybenzene (20367-35-5) + 2-butoxyphenol (39075-90-6) + 1-n-butoxy-2-methoxybenzene (51241-33-9) + 2-methoxy-phenol (90-05-1)

Guidance literature:

at 220 ℃; for 0.666667h; Inert atmosphere; Microwave irradiation;

DOI:10.1055/s-0030-1258087

upstream raw materials:

1-bromo-butane

sodium catecholate

1-iodo-butane

benzene-1,2-diol

Downstream raw materials:

1,2-dibutoxy-4-chloromethyl-benzene

(3,4-dibutoxy-phenyl)-glyoxylic acid ethyl ester

1,2-dibutoxy-4,5-dinitrobenzene

1,2-dibutoxy-4,5-bis(chloromethyl)benzene

Refernces

• 1、 Vadivel, Marichandran,Singh, Shikha,Singh, Dharmendra Pratap,Raghunathan,Kumar, Sandeep. "Ambipolar Charge Transport Properties of Naphthophenanthridine Discotic Liquid Crystals". . p. 10364 - 10372. Retrieved 2021/09/18.
• 2、 Platonova, Yana B.,Volov, Alexander N.,Tomilova, Larisa G.. "Palladium(II) octaalkoxy- and octaphenoxyphthalocyanines: Synthesis and evaluation as catalysts in the Sonogashira reaction". . p. 222 - 227. Retrieved 2019/04/17.