Spiro[2.7]decan-4-one

Base Information

• Chemical Name: Spiro[2.7]decan-4-one
• CAS No.: 935-61-5
• Molecular Formula: C₁₀H₁₆O
• Molecular Weight: 152.236
• DSSTox Substance ID: DTXSID60538930
• Wikidata: Q82414506
• Mol file: 935-61-5.mol

Synonyms:spiro[2.7]decan-4-one;935-61-5;spiro[2.7]decan-10-one;spiro[2.7]decan-4-on;SCHEMBL7638818;DTXSID60538930;YETZKAVEKAPJCJ-UHFFFAOYSA-N;MFCD22053988;SB40066;CS-0341280

Chemical Property of Spiro[2.7]decan-4-one

Chemical Property:

• PSA: 17.07000
• LogP: 2.68990
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 152.120115130
• Heavy Atom Count: 11
• Complexity: 168

Purity/Quality:

97% ^*data from raw suppliers

Spiro[2.7]decan-4-one ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CCCC2(CC2)C(=O)CC1

Technology Process of Spiro[2.7]decan-4-one

There total 6 articles about Spiro[2.7]decan-4-one 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: 85.0%

cycloactanone (502-49-8) + 2-chloroethyl dimethyl sulfonium iodide (25059-70-5) → Spiro<2.7>decan-4-one (935-61-5)

Guidance literature:

With potassium tert-butylate; In tert-butyl alcohol;

DOI:10.1016/S0040-4039(01)81610-5

Reference yield: 58.0%

spiro<2,7>decane (185-87-5) → Spiro<2.7>decan-4-one (935-61-5)

Guidance literature:

With silica gel; ozone; at -50 ℃; for 1h; Reagent/catalyst;

DOI:10.1002/ejoc.201701671

Reference yield: 19.0%

bicyclo[6.1.0]nonane (286-60-2) → Spiro<2.7>decan-4-one (935-61-5) + Spiro<2.7>decan-5-on (51364-58-0)

Guidance literature:

With Oxone; 1,1,1-trifluoro-2-propanone; sodium hydrogencarbonate; In water; at -70 - -20 ℃; for 2h;

DOI:10.1002/ejoc.201701671

upstream raw materials:

cycloactanone

2-chloroethyl dimethyl sulfonium iodide

2,2-Bis-brommethyl-cyclooctan-1-on

2,2-Bis-tosyloxymethyl-cyclooctan-1-on

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