2,3-Dihydro-1,1,3-trimethyl-1H-indene

Base Information

• Chemical Name: 2,3-Dihydro-1,1,3-trimethyl-1H-indene
• CAS No.: 2613-76-5
• Molecular Formula: C12H16
• Molecular Weight: 160.259
• Hs Code.: 2902909090
• NSC Number: 16797
• DSSTox Substance ID: DTXSID301345933
• Nikkaji Number: J20.939B
• Mol file: 2613-76-5.mol

Synonyms:2,3-Dihydro-1,1,3-trimethyl-1H-indene;2613-76-5;Indan, 1,1,3-trimethyl-;1H-Indene, 2,3-dihydro-1,1,3-trimethyl-;1,1,3-Trimethylindane;1,1,3-TRIMETHYLINDAN;1,3,3-trimethylindane;1,3,3-trimethyl-1,2-dihydroindene;NSC16797;1,3-Trimethylindan;1,3-Trimethylindane;Indan,1,3-trimethyl-;1,1,3-trimethyl-indan;Indane, 1,1,3-trimethyl;2,1,3-trimethyl-1H-indene;DTXSID301345933;NSC 16797;NSC-16797;1,3-Trimethyl-[2,3-dihydroindene];1,1,3-Trimethyl-(2,3-dihydroindene);1H-Indene,3-dihydro-1,1,3-trimethyl-

Chemical Property of 2,3-Dihydro-1,1,3-trimethyl-1H-indene

Chemical Property:

• Vapor Pressure: 0.205mmHg at 25°C
• Boiling Point: 216.5°C at 760 mmHg
• Flash Point: 78.1°C
• PSA: 0.00000
• Density: 0.905g/cm³
• LogP: 3.47140
• XLogP3: 4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 160.125200510
• Heavy Atom Count: 12
• Complexity: 169

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CC(C2=CC=CC=C12)(C)C

Technology Process of 2,3-Dihydro-1,1,3-trimethyl-1H-indene

There total 10 articles about 2,3-Dihydro-1,1,3-trimethyl-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:

thiophene (188290-36-0,8014-23-1,25233-34-5) + 2,4-diphenyl-2-methylpentane (31516-55-9) → Isopropylbenzene (98-82-8) + 1,3,3-trimethylindane (2613-76-5) + ethylbenzene (100-41-4,27536-89-6) + benzene (71-43-2,26181-88-4,54682-86-9,13967-78-7,174973-66-1)

Guidance literature:

at 350 ℃; under 51485.6 Torr; Hydrogenation;

DOI:10.1021/ja01564a073

Reference yield:

2-methyl-2,4-pentanediol (107-41-5) → 1,3,3-trimethylindane (2613-76-5) + 4-methyl-4-phenyl-pentan-2-ol (2035-93-0)

Guidance literature:

With aluminium trichloride; benzene;

Reference yield:

2-methyl-2,4-pentanediol (107-41-5) + aluminium trichloride (7446-70-0) + benzene (71-43-2,26181-88-4,54682-86-9,13967-78-7,174973-66-1) → 1,3,3-trimethylindane (2613-76-5) + 4-methyl-4-phenyl-pentan-2-ol (2035-93-0)

Guidance literature:

upstream raw materials:

2-methyl-2,4-pentanediol

4-chloro-4-methyl-1-pentetne

benzene

(1,3-dimethylbutyl)benzene

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