7-Oxabicyclo[4.1.0]heptane-3-methanol

Base Information

• Chemical Name: 7-Oxabicyclo[4.1.0]heptane-3-methanol
• CAS No.: 767-11-3
• Molecular Formula: C₇H₁₂O₂
• Molecular Weight: 128.171
• DSSTox Substance ID: DTXSID10436831
• Nikkaji Number: J695.217H
• Mol file: 767-11-3.mol

Synonyms:7-Oxabicyclo[4.1.0]heptane-3-methanol;767-11-3;7-oxabicyclo[4.1.0]heptan-3-ylmethanol;3,4-epoxycyclohexylmethanol;SCHEMBL658175;3,4-Epoxy-1-cyclohexanemethanol;DTXSID10436831;{7-oxabicyclo[4.1.0]heptan-3-yl}methanol

Chemical Property of 7-Oxabicyclo[4.1.0]heptane-3-methanol

Chemical Property:

• PSA: 32.76000
• LogP: 0.54620
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 128.083729621
• Heavy Atom Count: 9
• Complexity: 114

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC2C(O2)CC1CO

Technology Process of 7-Oxabicyclo[4.1.0]heptane-3-methanol

There total 3 articles about 7-Oxabicyclo[4.1.0]heptane-3-methanol 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: 99.0%

cyclohex-3-enylmethanol (72581-32-9,1679-51-2) → (1R*,3R*,6S*)-7-oxabicyclo[4.1.0]hept-3-ylmethanol (767-11-3,91108-45-1,91108-46-2,120522-61-4)

Guidance literature:

With [2-percarboxyethyl] functionalized silica; In dichloromethane; at 20 ℃; for 1h;

DOI:10.1021/jo300533b

Reference yield:

(cyclohex-3-enylmethoxy)-trimethyl-silane → (1R*,3R*,6S*)-7-oxabicyclo[4.1.0]hept-3-ylmethanol (767-11-3,91108-45-1,91108-46-2,120522-61-4)

Guidance literature:

With disodium hydrogenphosphate; dihydrogen peroxide; Hexafluoroacetone; dibutyl ether; In various solvent(s); at 20 ℃; for 20h;

DOI:10.1055/s-2001-16037

Reference yield:

→ (1R*,3R*,6S*)-7-oxabicyclo[4.1.0]hept-3-ylmethanol (767-11-3,91108-45-1,91108-46-2,120522-61-4)

Guidance literature:

upstream raw materials:

cyclohex-3-enylmethanol

Downstream raw materials:

Acetic acid (1S,3S,6R)-1-(7-oxa-bicyclo[4.1.0]hept-3-yl)methyl ester

Refernces

• 1、 -. "Vinyl ether compounds and polymerizable compositions". Page/Page column 20. . Retrieved 2008/12/08.
• 2、 Kostoryz, Elisabet L.,Smith, Robert E.,Glaros, Alan G.,Chappelow, Cecil C.,Eick, J. David. "In vitro mutagenicity and metabolism of the cycloaliphatic epoxy Cyracure UVR 6105". . p. 25 - 34. Retrieved 2007/10/03.