3a,6,7,7a-Tetrahydro-1H-indene

Base Information

• Chemical Name: 3a,6,7,7a-Tetrahydro-1H-indene
• CAS No.: 13320-60-0
• Molecular Formula: C₉H₁₂
• Molecular Weight: 120.194
• DSSTox Substance ID: DTXSID60508057
• Nikkaji Number: J53.407B
• Mol file: 13320-60-0.mol

Synonyms:3a,6,7,7a-Tetrahydro-1H-indene;13320-60-0;DTXSID60508057

Chemical Property of 3a,6,7,7a-Tetrahydro-1H-indene

Chemical Property:

• XLogP3: 2.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 120.093900383
• Heavy Atom Count: 9
• Complexity: 153

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC2CC=CC2C=C1

Technology Process of 3a,6,7,7a-Tetrahydro-1H-indene

There total 6 articles about 3a,6,7,7a-Tetrahydro-1H-indene 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:

cis-bicyclo<4.3.0>nona-3,7-diene (3048-65-5,38451-18-2,66563-20-0,98102-87-5,98102-88-6,117179-82-5) → INDANE (496-11-7) + bicyclo<4.3.0>nona-2,9-diene (90642-40-3) + cis-bicyclo<4.3.0>nona-2,8-diene (7603-35-2,13320-60-0) + brexan-5-ol acetate (53439-35-3,77844-44-1,102130-71-2)

Guidance literature:

With boron trifluoride; acetic acid; In octane; at 112 ℃; for 1h; Yield given. Further byproducts given. Yields of byproduct given. Title compound not separated from byproducts;

Reference yield:

cis-bicyclo<4.3.0>nona-3,7-diene (3048-65-5,38451-18-2,66563-20-0,98102-87-5,98102-88-6,117179-82-5) + acetic acid (64-19-7,77671-22-8) → INDANE (496-11-7) + bicyclo<4.3.0>nona-2,9-diene (90642-40-3) + Acetic acid (3aR,7aS)-(2,3,3a,4,7,7a-hexahydro-1H-inden-1-yl) ester (102060-29-7,139448-24-1,139448-25-2,139560-21-7) + cis-bicyclo<4.3.0>nona-2,8-diene (7603-35-2,13320-60-0)

Guidance literature:

With boron trifluoride; In hexane; at 80 ℃; for 1h; Yield given. Further byproducts given. Yields of byproduct given. Title compound not separated from byproducts;

Reference yield:

cis-bicyclo<4.3.0>nona-3,7-diene (3048-65-5,38451-18-2,66563-20-0,98102-87-5,98102-88-6,117179-82-5) + acetic acid (64-19-7,77671-22-8) → INDANE (496-11-7) + bicyclo<4.3.0>nona-2,9-diene (90642-40-3) + Acetic acid (3aR,7aS)-(2,3,3a,4,7,7a-hexahydro-1H-inden-2-yl) ester (80773-47-3,102060-30-0) + cis-bicyclo<4.3.0>nona-2,8-diene (7603-35-2,13320-60-0)

Guidance literature:

With boron trifluoride; In hexane; at 80 ℃; for 1h; Yield given. Further byproducts given. Yields of byproduct given. Title compound not separated from byproducts;

upstream raw materials:

cis-bicyclo<4.3.0>nona-3,7-diene

acetic acid

Downstream raw materials:

octahydro-5H-inden-5-one

2-Hydroxy-bicyclo<4.3.0>nonan

Hydrindanol-(5)

Refernces