Diallyl hexahydrophthalate

Base Information

• Chemical Name: Diallyl hexahydrophthalate
• CAS No.: 13846-31-6
• Molecular Formula: C14H20 O4
• Molecular Weight: 252.3062
• European Community (EC) Number: 237-580-1
• NSC Number: 408021
• DSSTox Substance ID: DTXSID10930122
• Nikkaji Number: J48.545D
• Mol file: 13846-31-6.mol

Synonyms:Diallyl hexahydrophthalate;13846-31-6;7500-82-5;bis(prop-2-enyl) cyclohexane-1,2-dicarboxylate;NSC 408021;1,2-Cyclohexanedicarboxylic acid, di-2-propenyl ester;EINECS 237-580-1;Cyclohexane-1,2-dicarboxylic acid, diallyl ester, (E)-;1,2-Cyclohexanedicarboxylic acid, di-2-propenyl ester, trans-;1,2-Cyclohexanedicarboxylic acid, 1,2-di-2-propen-1-yl ester;SCHEMBL987648;DTXSID10930122;1, di-2-propenyl ester, trans-;WLN: L6TJ AVO1U2 BVO1U2;NSC408021;Cyclohexane-1, diallyl ester, (E)-;NSC-408021;LS-56777;Diprop-2-en-1-yl cyclohexane-1,2-dicarboxylate;1,2-Cyclohexanedicarboxylic acid di-2-propenyl ester;1,2-Cyclohexanedicarboxylic acid, di-propen-1-yl ester

Chemical Property of Diallyl hexahydrophthalate

Chemical Property:

• Vapor Pressure: 0.000165mmHg at 25°C
• Boiling Point: 330.6°Cat760mmHg
• Flash Point: 156.9°C
• PSA: 0.00000
• Density: 1.06g/cm³
• LogP: 0.00000
• Water Solubility.: 110mg/L at 20℃
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 252.13615911
• Heavy Atom Count: 18
• Complexity: 290

Purity/Quality:

99.9% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: C=CCOC(=O)C1CCCCC1C(=O)OCC=C