Diallyl 4-cyclohexene-1,2-dicarboxylate

Base Information

• Chemical Name: Diallyl 4-cyclohexene-1,2-dicarboxylate
• CAS No.: 7495-85-4
• Molecular Formula: C14H18 O4
• Molecular Weight: 250.295
• European Community (EC) Number: 231-348-3
• NSC Number: 407780
• DSSTox Substance ID: DTXSID20996451
• Nikkaji Number: J48.237D
• Mol file: 7495-85-4.mol

Synonyms:Diallyl tetrahydrophthalate;Diallyl 4-cyclohexene-1,2-dicarboxylate;7495-85-4;EINECS 231-348-3;NSC 407780;BRN 2281986;AI3-22280;4-Cyclohexene-1,2-dicarboxylic acid, diallyl ester;4-Cyclohexene-1,2-dicarboxylic acid, di-2-propenyl ester;3-09-00-03945 (Beilstein Handbook Reference);SCHEMBL472107;4-Cyclohexene-1, diallyl ester;DTXSID20996451;NSC407780;WLN: L6UTJ DVO2U1 EVO2U1;4-Cyclohexene-1, di-2-propenyl ester;NSC-407780;LS-57478;diprop-2-en-1-yl cyclohex-4-ene-1,2-dicarboxylate;4-Cyclohexene-1,2-dicarboxylic acid di-2-propenyl ester

Chemical Property of Diallyl 4-cyclohexene-1,2-dicarboxylate

Chemical Property:

• Vapor Pressure: 0.000176mmHg at 25°C
• Boiling Point: 329.6°C at 760 mmHg
• Flash Point: 157.1°C
• PSA: 52.60000
• Density: 1.082g/cm³
• LogP: 2.02720
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 250.12050905
• Heavy Atom Count: 18
• Complexity: 323

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=CCOC(=O)C1CC=CCC1C(=O)OCC=C

Technology Process of Diallyl 4-cyclohexene-1,2-dicarboxylate

There total 2 articles about Diallyl 4-cyclohexene-1,2-dicarboxylate 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:

allyl alcohol (107-18-6) + cis-1,2,3,6-tetrahydrophthalic anhydride (935-79-5) → cyclohex-4-ene-1,2-dicarboxylic acid diallyl ester (7495-85-4)

Guidance literature:

With benzenesulfonic acid; Entfernen des entstehenden Wassers;

Reference yield:

→ cyclohex-4-ene-1,2-dicarboxylic acid diallyl ester (7495-85-4)

Guidance literature:

Tetrahydrophthalsaeureanhydrid, Allylalkohol;

Reference yield:

cyclohex-4-ene-1,2-dicarboxylic acid diallyl ester (7495-85-4) → 4,5-epoxy-cyclohexane-1,2-dicarboxylic acid diallyl ester (5460-98-0)

Guidance literature:

With hypochloric acid; Behandeln des Reaktionsprodukts mit aethanol. Natronlauge;

DOI:10.1039/jr9520004630

upstream raw materials:

allyl alcohol

cis-1,2,3,6-tetrahydrophthalic anhydride

Downstream raw materials:

4,5-epoxy-cyclohexane-1,2-dicarboxylic acid diallyl ester