2,2-Bis(3,4-epoxycyclohexyl)propane

Base Information

• Chemical Name: 2,2-Bis(3,4-epoxycyclohexyl)propane
• CAS No.: 14513-43-0
• Molecular Formula: C₁₅H₂₄O₂
• Molecular Weight: 236.354
• European Community (EC) Number: 604-463-5
• DSSTox Substance ID: DTXSID60464422
• Nikkaji Number: J1.648.223D
• Mol file: 14513-43-0.mol

Synonyms:14513-43-0;2,2-Bis(3,4-epoxycyclohexyl)propane;3-[2-(7-oxabicyclo[4.1.0]heptan-3-yl)propan-2-yl]-7-oxabicyclo[4.1.0]heptane;7-Oxabicyclo[4.1.0]heptane, 3,3'-(1-methylethylidene)bis- (9CI);3,3'-(1-METHYLETHYLIDENE)BIS-7-OXABICYCLO[4.1.0]HEPTANE;SCHEMBL16120;DTXSID60464422;J-640016;J-800018;3,3'-(Propane-2,2-diyl)bis(7-oxabicyclo[4.1.0]heptane);3,3-(1-Methylethylidene)bis-7-oxabicyclo[4.1.0]heptane;3,3/'/'-(1-METHYLETHYLIDENE)BIS-7-OXABICYCLO[4.1.0]HEPTANE

Chemical Property of 2,2-Bis(3,4-epoxycyclohexyl)propane

Chemical Property:

• Boiling Point: 298.2 °C at 760 mmHg
• Flash Point: 121 °C
• PSA: 25.06000
• Density: 1.1 g/cm³
• LogP: 3.14760
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 236.177630004
• Heavy Atom Count: 17
• Complexity: 295

Purity/Quality:

98%Min ^*data from raw suppliers

3,3'-(1-METHYLETHYLIDENE)BIS-7-OXABICYCLOHEPTANE 96.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C1CCC2C(C1)O2)C3CCC4C(C3)O4

Technology Process of 2,2-Bis(3,4-epoxycyclohexyl)propane

There total 3 articles about 2,2-Bis(3,4-epoxycyclohexyl)propane 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: 90.0%

4-(2-cyclohex-3-en-1-ylpropyl-2-yl)cyclohexene (59095-15-7) → 4-(2-cyclohex-3-epoxy-1-ylpropyl-2-yl)epoxycyclohexane (14513-43-0)

Guidance literature:

With dipotassium hydrogenphosphate; Octanoic acid; dihydrogen peroxide; In water; toluene; at 40 ℃; for 24h;

Reference yield: 65.0%

4-(2-cyclohex-3-en-1-ylpropyl-2-yl)cyclohexene (59095-15-7) → 4-(2-cyclohex-3-epoxy-1-ylpropyl-2-yl)epoxycyclohexane (14513-43-0) + 4-(2-cyclohex-3-en-1-ylpropyl-2-yl)epoxycyclohexane

Guidance literature:

With sodium dihydrogenphosphate; tris(cetylpyridinium) 12-tungstophosphate; In chloroform; at 60 - 70 ℃; for 50h; Reagent/catalyst;

Reference yield:

4,4'-isopropylidenedicyclohexanol (13804-54-1,13804-57-4,13804-58-5,80-04-6) → 4-(2-cyclohex-3-epoxy-1-ylpropyl-2-yl)epoxycyclohexane (14513-43-0)

Guidance literature:

Multi-step reaction with 2 steps

1: sodium hydrogen sulfate / water / 100 °C / Inert atmosphere

2: peracetic acid / ethyl acetate / 5 h / 30 °C / Inert atmosphere

With peracetic acid; sodium hydrogen sulfate; In water; ethyl acetate;

upstream raw materials:

4-(2-cyclohex-3-en-1-ylpropyl-2-yl)cyclohexene

4,4'-isopropylidenedicyclohexanol