(E)-N-[2-(2,3-Dihydro-6-methoxy-1H-inden-1-ylidene)ethyl]propanamide

Base Information

• Chemical Name: (E)-N-[2-(2,3-Dihydro-6-methoxy-1H-inden-1-ylidene)ethyl]propanamide
• CAS No.: 196597-82-7
• Molecular Formula: C15H19NO2
• Molecular Weight: 245.321
• DSSTox Substance ID: DTXSID60454727
• Nikkaji Number: J2.285.924B,J1.473.191A
• ChEMBL ID: CHEMBL133763
• Mol file: 196597-82-7.mol

Synonyms:196597-82-7;(E)-N-[2-(2,3-Dihydro-6-methoxy-1H-inden-1-ylidene)ethyl]propanamide;N-[(2E)-2-(6-methoxy-2,3-dihydroinden-1-ylidene)ethyl]propanamide;CHEMBL133763;N-[2-(6-Methoxyindan-1-ylidene)ethyl]propionamide;N-{2-[(1E)-6-methoxy-2,3-dihydro-1H-inden-1-ylidene]ethyl}propanamide;SCHEMBL1724137;SCHEMBL1724140;DTXSID60454727;BDBM50118438;J-012709;N-[2-[(E)-6-Methoxyindan-1-ylidene]ethyl]propionamide;(E) N-[2-(6-Methoxy-indan-1-ylidene)-ethyl]-propionamide

Chemical Property of (E)-N-[2-(2,3-Dihydro-6-methoxy-1H-inden-1-ylidene)ethyl]propanamide

Chemical Property:

• PSA: 41.82000
• LogP: 3.39130
• Storage Temp.: Refrigerator
• Solubility.: Chloroform (Slightly), Methanol (Slightly)
• XLogP3: 2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 245.141578849
• Heavy Atom Count: 18
• Complexity: 325

Purity/Quality:

98% ^*data from raw suppliers

(E)-N-[2-(2,3-Dihydro-6-methoxy-1H-inden-1-ylidene)ethyl]propanamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCC(=O)NCC=C1CCC2=C1C=C(C=C2)OC
• Isomeric SMILES: CCC(=O)NC/C=C/1\CCC2=C1C=C(C=C2)OC

Technology Process of (E)-N-[2-(2,3-Dihydro-6-methoxy-1H-inden-1-ylidene)ethyl]propanamide

There total 3 articles about (E)-N-[2-(2,3-Dihydro-6-methoxy-1H-inden-1-ylidene)ethyl]propanamide 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: 78.0%

propionyl chloride (79-03-8) + (E)-2-(2,3-dihydro-6-methoxy-1H-inden-1-ylidene)ethanamine (178676-73-8) → (Z)-N-[2-(6-methoxyindan-1-ylidene)ethyl]propionamide (196597-82-7)

Guidance literature:

Reference yield:

6-methoxy-2,3-dihydro-1H-inden-1-one (13623-25-1) → (Z)-N-[2-(6-methoxyindan-1-ylidene)ethyl]propionamide (196597-82-7)

Guidance literature:

Multi-step reaction with 3 steps

1.1: NaH / tetrahydrofuran / 20 °C

1.2: tetrahydrofuran / 20 °C

2.1: H₂; ethanolic NH₃ / Raney-Co

3.1: Et₃N / tetrahydrofuran / 0 °C

With ammonia; hydrogen; sodium hydride; triethylamine; Raney-Co; In tetrahydrofuran; 1.2: Horner-Emmons reaction;

DOI:10.1021/jm0201159

Reference yield:

(E)-(2,3-dihydro-6-methoxy-1H-inden-1-ylidene)acetonitrile (187871-98-3) → (Z)-N-[2-(6-methoxyindan-1-ylidene)ethyl]propionamide (196597-82-7)

Guidance literature:

Multi-step reaction with 2 steps

1: H₂; ethanolic NH₃ / Raney-Co

2: Et₃N / tetrahydrofuran / 0 °C

With ammonia; hydrogen; triethylamine; Raney-Co; In tetrahydrofuran;

DOI:10.1021/jm0201159

upstream raw materials:

propionyl chloride

(E)-2-(2,3-dihydro-6-methoxy-1H-inden-1-ylidene)ethanamine

6-methoxy-2,3-dihydro-1H-inden-1-one

(E)-(2,3-dihydro-6-methoxy-1H-inden-1-ylidene)acetonitrile

Downstream raw materials:

(S)-N-[2-(6-methoxyindan-1-yl)ethyl]propanamide

(S)-N-[2-(7-allyl-5-bromo-6-hydroxy-2,3-dihydro-1H-inden-1-yl)ethyl]propionamide

(S)-N-[2-(6-hydroxy-7-(2-hydroxyethyl)-2,3-dihydro-1H-inden-1-yl)ethyl]propionamide

(S)-N-[2-(6-allyloxy-5-bromo-2,3-dihydro-1H-inden-1-yl)ethyl]propionamide

Post a RFQ

Cas No.:

Product Name:

Quantity:

Please select Metric Ton KG G Pound L ML

Email:

Company name:

Valid Period:

Detailed Requirements:

• Sample
• MOQ
• GMP
• FDA
• Price
  FOB CIF CFR EXW
• Urgent purchase

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

Remove

Submit

1

What can I do for you?
Get Best Price

Get Best Price for 196597-82-7 (E)-N-[2-(2,3-Dihydro-6-methoxy-1H-inden-1-ylidene)ethyl]propanamide

Send

Send

Metric Ton KG G Pound L ML

Send

Send