1alpha-Methoxy-2,3-dihydro-1H-inden-2beta-ol

Base Information

• Chemical Name: 1alpha-Methoxy-2,3-dihydro-1H-inden-2beta-ol
• CAS No.: 56175-45-2
• Molecular Formula: C₁₀H₁₂O₂
• Molecular Weight: 164.204
• DSSTox Substance ID: DTXSID801242209
• Nikkaji Number: J700.337D
• Mol file: 56175-45-2.mol

Synonyms:DTXSID801242209;1alpha-Methoxy-2,3-dihydro-1H-inden-2beta-ol;rel-(1R,2R)-2,3-Dihydro-1-methoxy-1H-inden-2-ol

Chemical Property of 1alpha-Methoxy-2,3-dihydro-1H-inden-2beta-ol

Chemical Property:

• XLogP3: 1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 164.083729621
• Heavy Atom Count: 12
• Complexity: 158

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC1C(CC2=CC=CC=C12)O
• Isomeric SMILES: CO[C@@H]1[C@H](CC2=CC=CC=C12)O

Technology Process of 1alpha-Methoxy-2,3-dihydro-1H-inden-2beta-ol

There total 14 articles about 1alpha-Methoxy-2,3-dihydro-1H-inden-2beta-ol 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: 93.0%

methanol (67-56-1) + 2,3-epoxyindene (768-22-9) → trans-1-methoxy-2-hydroxyindan (56175-44-1,56175-45-2,71192-96-6,71720-52-0)

Guidance literature:

With sodium perchlorate; for 0.333333h; Ambient temperature; electrolysis;

DOI:10.1246/bcsj.68.2591

Reference yield: 65.5%

sodium methylate (124-41-4) + (1aR,6aS)-6,6a-dihydro-1aH-indeno[1,2-b]oxirene (768-22-9,67528-26-1,71214-81-8,85354-35-4) → trans-1-methoxyindan-2-ol (56175-44-1,56175-45-2,71192-96-6,71720-52-0)

Guidance literature:

In methanol; chloroform; water;

Reference yield:

methanol (67-56-1) + 1-indene (95-13-6) → cis-indane-1,2-diol (4370-02-9,4647-42-1,4647-43-2,67528-22-7,67528-23-8,71214-80-7,71214-82-9,78737-68-5) + trans-1-methoxy-2-hydroxyindan (56175-44-1,56175-45-2,71192-96-6,71720-52-0) + (+/-)-3,4-Dihydro-1,3-dimethoxy-1H-2-benzopyran (100058-92-2) + cis-1-methoxy-2-indanol (56175-44-1,56175-45-2,71192-96-6,71720-52-0)

Guidance literature:

With sodium tetrahydroborate; methylene blue; Yield given. Multistep reaction. Yields of byproduct given; 1.) 28 h, irrad., 2.) RT, 24 h;

DOI:10.1246/bcsj.53.2655

upstream raw materials:

sodium methylate

(1aR,6aS)-6,6a-dihydro-1aH-indeno[1,2-b]oxirene

methanol

1-indene

Downstream raw materials:

(1S,2R)-1-amino-2-indanol