4-Fluoro-2,3-dihydro-1H-inden-1-amine

Base Information

• Chemical Name: 4-Fluoro-2,3-dihydro-1H-inden-1-amine
• CAS No.: 148960-34-3
• Molecular Formula: C₉H₁₀FN
• Molecular Weight: 151.184
• European Community (EC) Number: 831-942-8
• DSSTox Substance ID: DTXSID80585663
• Mol file: 148960-34-3.mol

Synonyms:148960-34-3;4-FLUORO-2,3-DIHYDRO-1H-INDEN-1-AMINE;148960-38-7;4-FLUORO-INDAN-1-YLAMINE;4-Fluoro-indan-1-ylamine hydrochloride;1H-Inden-1-amine,4-fluoro-2,3-dihydro-,(-)-(9ci);1H-INDEN-1-AMINE, 4-FLUORO-2,3-DIHYDRO-;4-FLUOROINDAN-1-YLAMINE HYDROCHLORIDE;4-FLUOROINDANYLAMINE;SCHEMBL1150855;DTXSID80585663;SIIMRBDZNUKOAC-UHFFFAOYSA-N;1H-INDEN-1-AMINE, 4-FLUORO-2,3-DIHYDRO-, (-)-;MFCD07373911;AKOS000223881;AKOS016042422;AB38279;AB38282;AB38283;SB75954;DS-15891;4-Fluoro-2,3-dihydro-1h-inden-1-ylamine;CS-0104995;EN300-58727;(-)-4-Fluoro-2,3-dihydro-1H-inden-1-amine;F16929;AB01004475-01;4-Fluoro-2 pound not3-dihydro-1H-inden-1-amine;A884318;J-515333

Chemical Property of 4-Fluoro-2,3-dihydro-1H-inden-1-amine

Chemical Property:

• Vapor Pressure: 0.0334mmHg at 25°C
• Refractive Index: 1.559
• Boiling Point: 242.8°C at 760 mmHg
• PKA: 8.85±0.20(Predicted)
• Flash Point: 86.2°C
• PSA: 26.02000
• Density: 1.259g/cm³
• LogP: 2.47200
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 151.079727485
• Heavy Atom Count: 11
• Complexity: 149

Purity/Quality:

97% ^*data from raw suppliers

4-fluoro-2,3-dihydro-1H-inden-1-amine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 22

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC2=C(C1N)C=CC=C2F

Technology Process of 4-Fluoro-2,3-dihydro-1H-inden-1-amine

There total 3 articles about 4-Fluoro-2,3-dihydro-1H-inden-1-amine 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: 71.0%

4-Fluorindanon-1-oxim (73045-31-5) → 1-fluoro-benzocyclopentyl-5-amine (148960-34-3,148960-38-7,1637635-81-4,946053-90-3)

Guidance literature:

With palladium on activated charcoal; hydrogen; In methanol; at 20 ℃; for 16h;

Reference yield: 50.0%

→ 1-fluoro-benzocyclopentyl-5-amine (148960-34-3,148960-38-7,1637635-81-4,946053-90-3)

Guidance literature:

Reference yield:

4-fluoro-1-indanone (699-99-0) → 1-fluoro-benzocyclopentyl-5-amine (148960-34-3,148960-38-7,1637635-81-4,946053-90-3)

Guidance literature:

Multi-step reaction with 2 steps

1: hydroxyamino hydrochloride; anhydrous Sodium acetate / methanol / 16 h / 60 °C / Sealed tube

2: hydrogen; palladium on activated charcoal / methanol / 16 h / 20 °C

With palladium on activated charcoal; hydroxyamino hydrochloride; hydrogen; anhydrous Sodium acetate; In methanol;

upstream raw materials:

4-fluoro-1-indanone

4-Fluorindanon-1-oxim

Downstream raw materials:

4-fluoro-1R-aminoindane

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