2,6-Dichlorobenzyl alcohol

Base Information

• Chemical Name: 2,6-Dichlorobenzyl alcohol
• CAS No.: 15258-73-8
• Molecular Formula: C7H6Cl2O
• Molecular Weight: 177.03
• Hs Code.: 29062990
• European Community (EC) Number: 239-300-3
• NSC Number: 215733
• UNII: J8KSU5EL67
• DSSTox Substance ID: DTXSID30165075
• Nikkaji Number: J81.837B
• Wikidata: Q72465590
• Mol file: 15258-73-8.mol

Synonyms:2,6-DICHLOROBENZYL ALCOHOL;15258-73-8;(2,6-Dichlorophenyl)methanol;Benzenemethanol, 2,6-dichloro-;2,6-Dichlorobenzenemethanol;Benzyl alcohol, 2,6-dichloro-;EINECS 239-300-3;NSC 215733;BRN 1938356;J8KSU5EL67;(2,6-dichloro-phenyl)-methanol;MFCD00004609;NSC-215733;Benzenemethanol, 2,6-dichloro- (9CI);2,6-Dichlorobenzylalcohol;2,6-dcal;NSC215733;C(O)c1c(Cl)cccc1Cl;UNII-J8KSU5EL67;2,6-Dichloro Benzyl Alcohol;SCHEMBL110369;(2,6-Dichlorophenyl)methanol #;DTXSID30165075;2,6-Dichlorobenzyl alcohol, 99%;[2,6-bis(chloranyl)phenyl]methanol;CK1136;STL456209;AKOS000249370;AM81458;CS-O-10648;AC-17026;LS-42810;SY004553;CS-0157020;D1747;FT-0610601;EN300-1263450;A809325;W-108051

Chemical Property of 2,6-Dichlorobenzyl alcohol

Chemical Property:

• Appearance/Colour: white crystalline powder
• Vapor Pressure: 0.00382mmHg at 25°C
• Melting Point: 96-98 °C(lit.)
• Refractive Index: 1.582
• Boiling Point: 268.4 °C at 760 mmHg
• PKA: 13.57±0.10(Predicted)
• Flash Point: 115 °C
• PSA: 20.23000
• Density: 1.392 g/cm³
• LogP: 2.48570
• Storage Temp.: Sealed in dry,Room Temperature
• Solubility.: Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 175.9795702
• Heavy Atom Count: 10
• Complexity: 97.8

Purity/Quality:

98%,99%, ^*data from raw suppliers

2,6-Dichlorobenzyl Alcohol >98.0%(GC) ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C(=C1)Cl)CO)Cl
• Uses: 2,6-Dichlorobenzyl Alcohol is a useful reagent in organic synthesis.

Technology Process of 2,6-Dichlorobenzyl alcohol

There total 14 articles about 2,6-Dichlorobenzyl alcohol 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: 99.0%

2,6-dichlorobenzaldehyde (83-38-5) → 2,6-dichlorobenzyl alcohol (15258-73-8)

Guidance literature:

With sodium tetrahydroborate; In methanol; at 0 ℃;

DOI:10.1002/cmdc.201600491

Reference yield: 95.0%

2,6-dichlorobenzoic acid methyl ester (14920-87-7) → 2,6-dichlorobenzyl alcohol (15258-73-8)

Guidance literature:

With zinc(II) tetrahydroborate; In ethanol; at 78 ℃; for 3h;

Reference yield: 93.0%

2-((2,6-dichlorobenzyl)oxy)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane → 2,6-dichlorobenzyl alcohol (15258-73-8)

Guidance literature:

With silica gel; In methanol; for 4h; Reflux;

DOI:10.1002/ejic.201901276

upstream raw materials:

2,6-dichlorobenzaldehyde

2,6-Dichlorobenzyl bromide

2,6-dichlorophenylacetylchloride

2,6-dichlorobenzalchloride

Downstream raw materials:

1,3-dichloro-2-(iodomethyl)benzene

N^ε-(2,6-Dichlorbenzyloxycarbonyl)-L-lysin

2,6-Dichlorbenzylchlorformiat

1,3-dichloro-2-methoxymethylbenzene

Refernces

• 1、 Xue, Benjing,Sun, Hongjian,Li, Xiaoyan. "Syntheses and catalytic application of hydrido iron(ii) complexes with [P,S]-chelating ligands in hydrosilylation of aldehydes and ketones". . p. 52000 - 52006. Retrieved 2015.
• 2、 Du, Xinyu,Qi, Xinghao,Li, Kai,Li, Xiaoyan,Sun, Hongjian,Fuhr, Olaf,Fenske, Dieter. "Synthesis and catalytic activity of N-heterocyclic silylene (NHSi) iron (II) hydride for hydrosilylation of aldehydes and ketones". . . Retrieved 2021/05/29.
• 3、 Chang, Guoliang,Fenske, Dieter,Fuhr, Olaf,Li, Xiaoyan,Sun, Hongjian,Xie, Shangqing,Yang, Wenjing,Zhang, Peng. "Pyridine: N-oxide promoted hydrosilylation of carbonyl compounds catalyzed by [PSiP]-pincer iron hydrides". . p. 9349 - 9354. Retrieved 2020/09/09.