Prop-2-en-1-yl 7-oxabicyclo[4.1.0]heptane-3-carboxylate

Base Information

• Chemical Name: Prop-2-en-1-yl 7-oxabicyclo[4.1.0]heptane-3-carboxylate
• CAS No.: 19900-47-1
• Molecular Formula: C₁₀H₁₄O₃
• Molecular Weight: 182.219
• NSC Number: 36609
• DSSTox Substance ID: DTXSID70284299
• Nikkaji Number: J2.395.099E
• Mol file: 19900-47-1.mol

Synonyms:19900-47-1;prop-2-en-1-yl 7-oxabicyclo[4.1.0]heptane-3-carboxylate;NSC36609;allyl 3,4-epoxycyclohexane-1-carboxylate;SCHEMBL942869;DTXSID70284299;WRGWYAZIVRHPFP-UHFFFAOYSA-N;NSC-36609;3,4-epoxycyclohexane-1-carboxylic acid allylester

Chemical Property of Prop-2-en-1-yl 7-oxabicyclo[4.1.0]heptane-3-carboxylate

Chemical Property:

• Vapor Pressure: 0.0123mmHg at 25°C
• Boiling Point: 260.4°Cat760mmHg
• Flash Point: 103.2°C
• Density: 1.124g/cm³
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 182.094294304
• Heavy Atom Count: 13
• Complexity: 224

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=CCOC(=O)C1CCC2C(C1)O2

Technology Process of Prop-2-en-1-yl 7-oxabicyclo[4.1.0]heptane-3-carboxylate

There total 2 articles about Prop-2-en-1-yl 7-oxabicyclo[4.1.0]heptane-3-carboxylate 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:

cyclohex-3-enecarboxylic acid allyl ester (77626-69-8) → allyl 3,4-epoxycyclohexane-1-carboxylate (19900-47-1)

Guidance literature:

With dihydrogen peroxide; methyl tri-n-octyl ammonium hydrogen sulfate; sodium tungstate; In water; at 25 - 70 ℃; for 3.75h; Product distribution / selectivity;

Reference yield:

→ allyl 3,4-epoxycyclohexane-1-carboxylate (19900-47-1)

Guidance literature:

With peracetic acid; ethyl acetate;

DOI:10.1021/ja01522a048

upstream raw materials:

cyclohex-3-enecarboxylic acid allyl ester

Refernces

• 1、 -. "PROCESS FOR PRODUCTION OF EPOXY COMPOUND". Page/Page column 10. . Retrieved 2010/12/30.
• 2、 -. "PRODUCTION PROCESS OF BIFUNCTIONAL EPOXY MONOMER BY SELECTIVE OXIDATION OF DIOLEFIN COMPOUND". Page/Page column 12-13. . Retrieved 2008/06/13.