(1-METHYL-1H-INDOL-2-YL)-METHANOL

Base Information

• Chemical Name: (1-METHYL-1H-INDOL-2-YL)-METHANOL
• CAS No.: 1485-22-9
• Molecular Formula: C10H11 N O
• Molecular Weight: 161.203
• Hs Code.: 2933990090
• NSC Number: 165233
• DSSTox Substance ID: DTXSID40304276
• Nikkaji Number: J700.770A
• Wikidata: Q82050099
• Mol file: 1485-22-9.mol

Synonyms:Indole-2-methanol,1-methyl- (7CI); (1-Methyl-1H-indol-2-yl)methanol;1-Methyl-1H-indole-2-methanol; 1-Methyl-2-(hydroxymethyl)indole;1-Methylindole-2-methanol; 2-(Hydroxymethyl)-1-methylindole; NSC 165233

Chemical Property of (1-METHYL-1H-INDOL-2-YL)-METHANOL

Chemical Property:

• Vapor Pressure: 3.73E-05mmHg at 25°C
• Melting Point: 108-110 °C(Solv: benzene (71-43-2))
• Boiling Point: 338.8°C at 760 mmHg
• PKA: 14.89±0.10(Predicted)
• Flash Point: 158.7°C
• PSA: 25.16000
• Density: 1.12g/cm³
• LogP: 1.67060
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 161.084063974
• Heavy Atom Count: 12
• Complexity: 160

Purity/Quality:

97% ^*data from raw suppliers

1-Methylindole-2-methanol ^*data from reagent suppliers

Safty Information:

• Statements: 41
• Safety Statements: 26-39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C2=CC=CC=C2C=C1CO
• Uses: 1-Methylindole-2-methanol is a reagent used in the synthesis of peroxisome proliferator activated receptors, PPARα and PPARγ partial agonists in the treatment of type 2 diabetes.

Technology Process of (1-METHYL-1H-INDOL-2-YL)-METHANOL

There total 10 articles about (1-METHYL-1H-INDOL-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: 95.0%

methyl 1-methyl-1H-indole-2-carboxylate (37493-34-8) → (1-methyl-1H-indol-2-yl)-methanol (1485-22-9)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at 0 - 20 ℃; for 2h;

DOI:10.1021/ja511231f

Reference yield: 95.0%

ethyl N-methylindole-2-carboxylate (18450-24-3) → (1-methyl-1H-indol-2-yl)-methanol (1485-22-9)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at 30 ℃; for 36h;

DOI:10.1007/s12039-013-0489-4

Reference yield: 93.0%

N-methyl-1H-indole-2-carboxylic acid (16136-58-6) → (1-methyl-1H-indol-2-yl)-methanol (1485-22-9)

Guidance literature:

With lithium aluminium tetrahydride;

DOI:10.1016/j.bmcl.2007.05.077

upstream raw materials:

N-methyl-1H-indole-2-carboxylic acid

methyl 1-methyl-1H-indole-2-carboxylate

ethyl N-methylindole-2-carboxylate

1-methyl-1H-indole-2-carboxaldehyde

Downstream raw materials:

2-(benzyloxymethyl)-1-methyl-1H-indole

9-methyl-4-(4-chlorophenyl)-2-tosyl-1,2,3,4-tetrahydro-β-carboline

9-methyl-4-(4-bromophenyl)-2-tosyl-1,2,3,4-tetrahydro-β-carboline

9-methyl-4-(4-methylphenyl)-2-tosyl-1,2,3,4-tetrahydro-β-carboline