Diallyl isophthalate

Base Information

• Chemical Name: Diallyl isophthalate
• CAS No.: 1087-21-4
• Deprecated CAS: 127002-01-1,163447-33-4,163447-33-4
• Molecular Formula: C14H14 O4
• Molecular Weight: 246.263
• Hs Code.: 2917399090
• European Community (EC) Number: 214-122-9
• NSC Number: 6098
• DSSTox Substance ID: DTXSID7051559
• Nikkaji Number: J53.657A
• Wikidata: Q72462624
• Mol file: 1087-21-4.mol

Synonyms:Diallyl isophthalate;1087-21-4;Di-2-propenyl isophthalate;1,3-Benzenedicarboxylic acid, di-2-propenyl ester;Isophthalic acid, diallyl ester;Dappu 100;Dapon M;bis(prop-2-enyl) benzene-1,3-dicarboxylate;NSC 6098;EINECS 214-122-9;BRN 2055011;AI3-16904;1,3-bis(prop-2-en-1-yl) benzene-1,3-dicarboxylate;25035-78-3;1,3-Benzenedicarboxylic acid, 1,3-di-2-propen-1-yl ester;Diallyl iso-phthalate;Isophthalic Acid Diallyl Ester;Daiso iso-dap;DIALLYL ISO-PHTHALATE RESIN;Daip alkyd 509;Daip alkyd 510;DAIF-SL;Dappu 100L;Isophthalic acid, di-(2-propenyl) ester;Isophthalic acid diallyl;Diallyl isophthalate resin;SCHEMBL157805;isophtalic acid, diallyl ester;WLN: 1U2OVR CVO2U1;DTXSID7051559;NSC6098;BAA08721;NSC-6098;MFCD00048174;AKOS015915996;AS-57335;LS-29774;FT-0624601;I0450;E77583;Isophthalic acid, diallyl ester (6CI,7CI,8CI);2-[(1-ADAMANTYLCARBONYL)AMINO]-4-(METHYLTHIO)BUTANOICACID

Chemical Property of Diallyl isophthalate

Chemical Property:

• Vapor Pressure: 4.56E-05mmHg at 25°C
• Melting Point: -3℃
• Refractive Index: 1.5230-1.5270
• Boiling Point: 349.9°Cat760mmHg
• Flash Point: 171.3°C
• PSA: 52.60000
• Density: 1.112g/cm³
• LogP: 2.37220
• Storage Temp.: 0-10°C
• Water Solubility.: 33.8mg/L at 25℃
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 246.08920892
• Heavy Atom Count: 18
• Complexity: 292

Purity/Quality:

99% ^*data from raw suppliers

Diallyl Isophthalate ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Plastics & Rubber -> Phthalate Esters
• Canonical SMILES: C=CCOC(=O)C1=CC(=CC=C1)C(=O)OCC=C

Technology Process of Diallyl isophthalate

There total 4 articles about Diallyl isophthalate 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:

isophthalic acid (121-91-5) + allyl alcohol (107-18-6) → diallyl isophthalate (1087-21-4,25035-78-3)

Guidance literature:

With sulfuric acid;

DOI:10.1002/pol.1955.120188902

Reference yield:

dimethyl Isophthalate (1459-93-4) + allyl alcohol (107-18-6) → diallyl isophthalate (1087-21-4,25035-78-3)

Guidance literature:

With sodium methylate;

DOI:10.1021/ie50586a034

Reference yield:

allyl alcohol (107-18-6) + benzene-1,3-dicarbonyl dichloride (99-63-8) → diallyl isophthalate (1087-21-4,25035-78-3)

Guidance literature:

DOI:10.1002/pol.1955.120188902

upstream raw materials:

isophthalic acid

allyl alcohol

dimethyl Isophthalate

benzene-1,3-dicarbonyl dichloride

Downstream raw materials:

allyl alcohol