(2,3-Dihydrobenzofuran-2-yl)methanol

Base Information

• Chemical Name: (2,3-Dihydrobenzofuran-2-yl)methanol
• CAS No.: 66158-96-1
• Molecular Formula: C9H10O2
• Molecular Weight: 150.177
• Hs Code.: 2932999099
• European Community (EC) Number: 695-220-2
• DSSTox Substance ID: DTXSID80383666
• Nikkaji Number: J2.557.339K
• Mol file: 66158-96-1.mol

Synonyms:(2,3-dihydrobenzofuran-2-yl)methanol;66158-96-1;2,3-dihydro-1-benzofuran-2-ylmethanol;(2,3-Dihydro-1-benzofuran-2-yl)methanol;2-(Hydroxymethyl)-2,3-dihydrobenzofuran;MFCD03086171;(2,3-Dihydro-benzofuran-2-yl)-methanol;SCHEMBL2255761;DTXSID80383666;2,3-Dihydrobenzofuran-2-methanol;ITMGMSZDAOAVNO-UHFFFAOYSA-N;2,3-Dihydro-2-benzofuranylmethanol;AMY41791;STR07578;2,3-dihydrobenzofuran-2-yl-methanol;BBL029876;STK802164;2-hydroxymethyl-2,3-dihydrobenzofuran;AKOS000300143;AKOS016842418;FS-2479;2,3-Dihydro-2-(hydroxymethyl)benzofuran;SY045474;2,3-Dihydro-2-(hydroxymethyl)benzo[b]furan;2-(Hydroxymethyl)-2,3-dihydro-1-benzofuran;4-chloro-2-(4-pyridyl)-6-methylpyrimidine;CS-0031351;FT-0720979;EN300-96358;A867512;J-506978;Z397587206

Chemical Property of (2,3-Dihydrobenzofuran-2-yl)methanol

Chemical Property:

• Vapor Pressure: 0.003mmHg at 25°C
• Refractive Index: 1.564
• Boiling Point: 272.024 °C at 760 mmHg
• PKA: 14.22±0.10(Predicted)
• Flash Point: 125.639 °C
• PSA: 29.46000
• Density: 1.172 g/cm³
• LogP: 0.98240
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 150.068079557
• Heavy Atom Count: 11
• Complexity: 136

Purity/Quality:

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

2-Hydroxymethyl-2,3-dihydrobenzofuran ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(OC2=CC=CC=C21)CO
• Uses: 2-Hydroxymethyl-2,3-dihydrobenzofuran (H947870) is a reactant used in the preparation of thromboxane A2 agonist indane derivatives. 2,3-dihydrobenzofuran-2-methanol is a reactant used in the preparation of thromboxane A2 agonist indane derivatives.

Technology Process of (2,3-Dihydrobenzofuran-2-yl)methanol

There total 3 articles about (2,3-Dihydrobenzofuran-2-yl)methanol 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: 52.0%

(2-benzyloxy-benzyl)-oxirane (62826-36-2) + acetone (67-64-1) → 2-hydroxymethyl-1H-2,3-dihydrobenzofuran (66158-96-1) + 4-[2-(benzyloxy)benzyl]-2,2-dimethyl-1,3-dioxolane (1071445-28-7)

Guidance literature:

With gold(III) chloride; at 20 ℃; for 0.25h;

DOI:10.1002/ejoc.201001214

Reference yield:

1-(2-acetoxy-phenyl)-3-chloro-propan-2-ol → 2-hydroxymethyl-1H-2,3-dihydrobenzofuran (66158-96-1) + 2-chloromethyl-2,3-dihydro-benzofuran (53491-32-0) + 2-methylbenzofuran (4265-25-2)

Guidance literature:

zuletzt bei 100grad;

Reference yield:

o-Allylphenol (1745-81-9) → 2-(oxiran-2-ylmethyl)phenol (64276-05-7) + 2-hydroxymethyl-1H-2,3-dihydrobenzofuran (66158-96-1)

Guidance literature:

With tert.-butylhydroperoxide; bis(acetylacetonate)oxovanadium; acetic acid; In dichloromethane; at 40 ℃; for 5h; Further Variations:; Reagents; Temperatures; reaction time; Product distribution;

DOI:10.1055/s-2002-31894

upstream raw materials:

o-Allylphenol

(2-benzyloxy-benzyl)-oxirane

acetone

Downstream raw materials:

2,3-dihydrobenzofuran-2-carbaldehyde

2,3-dihydrobenzofuran-2-carbonyl chloride

Refernces

• 1、 Lattanzi, Alessandra,Scettri, Arrigo. "VO(acac)2/TBHP catalyzed epoxidation of 2-(2-alkenyl)phenols. Highly regio- and diastereoselective oxidative cyclization to 2,3-dihydrobenzofuranols and 3-chromanols". . p. 942 - 946. Retrieved 2007/10/03.