Bendiocarb phenol

Base Information

• Chemical Name: Bendiocarb phenol
• CAS No.: 22961-82-6
• Molecular Formula: C9H10O3
• Molecular Weight: 166.177
• Hs Code.: 2932999099
• European Community (EC) Number: 400-900-7
• UN Number: 3082
• DSSTox Substance ID: DTXSID3066845
• Nikkaji Number: J743.942C
• Wikidata: Q81993414
• Mol file: 22961-82-6.mol

Synonyms:Bendiocarb phenol;22961-82-6;2,2-dimethyl-2H-1,3-benzodioxol-4-ol;2,2-Dimethyl-1,3-benzodioxol-4-ol;1,3-Benzodioxol-4-ol, 2,2-dimethyl-;2,2-Dimethyl-4-hydroxy-1,3-benzodioxole;RCRA waste no. U364;SCHEMBL3156898;DTXSID3066845;2 3-(Isopropylidenedioxy)phenol;Fenol, 2,3-(isopropilidenedioxi);22-Dimethyl-13-benzodioxol-4-ol;2,2-dimethyl-1,3-dioxaindan-4-ol;2,2-Dimethyl-4-hydroxybenzodioxolane;2,2-Dimetil-1,3-benzodioxol-4-ol;AKOS006272815;Phenol23-(isopropylidenedioxy)-(8CI);1,3-Benzodioxol-4-ol, 2,2-dimethyl;1,3-benzodioxol-4-ol, 2,2-dimetil-;2,2-dimetil-4-hidroxi-1,3-benzodioxol;2 2-Dimethylbenzo[d][1 3]dioxol-4-ol;2,2-dimethylbenzo[d][1,3]dioxol-4-ol;2,2-dimethylbenzo[d]1,3-dioxolan-4-ol;2 2-Dimethyl-4-hydroxy-1 3-benzodioxole;4-hydroxy-2,2-dimethyl-1,3-benzodioxole;EN300-177761;Z1198154502;2-Methyl-N-[(2Z)-3-(2-methylphenyl)-4-vinyl-1,3-oxazolidin-2-ylidene]aniline

Chemical Property of Bendiocarb phenol

Chemical Property:

• Appearance/Colour: White crystalline solid
• Vapor Pressure: 0.0257mmHg at 25°C
• Refractive Index: 1.547
• Boiling Point: 239.586 °C at 760 mmHg
• Flash Point: 98.699 °C
• PSA: 38.69000
• Density: 1.209 g/cm³
• LogP: 1.89950
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 166.062994177
• Heavy Atom Count: 12
• Complexity: 179

Purity/Quality:

99.9% ^*data from raw suppliers

2,2-dimethyl-2H-1,3-benzodioxol-4-ol ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 41
• Safety Statements: 24-26-39

MSDS Files:

Useful:

• Chemical Classes: Other Classes -> Phenols
• Canonical SMILES: CC1(OC2=CC=CC(=C2O1)O)C

Technology Process of Bendiocarb phenol

There total 8 articles about Bendiocarb phenol 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: 90.5%

2-Methoxypropene (116-11-0) + 2-hydroxyresorcinol (87-66-1) → 2,2-Dimethyl-4-hydroxy-1,3-benzodioxole (22961-82-6)

Guidance literature:

In 5,5-dimethyl-1,3-cyclohexadiene; at 130 ℃; for 8h; Solvent; Temperature;

Reference yield: 86.0%

2,2-dimethoxy-propane (77-76-9) → 2,2-Dimethyl-4-hydroxy-1,3-benzodioxole (22961-82-6)

Guidance literature:

With 2-hydroxyresorcinol; In toluene;

Reference yield: 50.0%

2,2-dimethoxy-propane (77-76-9) + 2-hydroxyresorcinol (87-66-1) → methanol (67-56-1) + 2,2-Dimethyl-4-hydroxy-1,3-benzodioxole (22961-82-6)

Guidance literature:

In toluene; for 12h; Heating;

upstream raw materials:

2,2-dimethoxy-propane

2-hydroxyresorcinol

bendiocarb

bisisopropenyl ether

Downstream raw materials:

Benzylbis<3-(2,2-dimethyl-1,3-benzodioxol-4-yloxy)propyl>amin

1,7-Bis(2,3-dihydroxyphenoxy)heptan

Tris<3-(2,2-dihydroxyphenoxy)propyl>amin-hydrochlorid

toluene-4-sulfonic acid 8-hydroxy-2,3-dihydrobenzo[1,4]dioxin-2-ylmethyl ester

Refernces

• 1、 -. "Preparation method of bendiocarb intermediate and active ingredient". Paragraph 0021; 0023; 0025; 0027; 0029; 0031. . Retrieved 2019/08/07.
• 2、 Wang, Qiquan,Lemley, Ann T.. "Competitive degradation and detoxification of carbamate insecticides by membrane anodic fenton treatment". . p. 5382 - 5390. Retrieved 2007/10/03.