2,2-Dimethylpropane-1,3-diyl cyclohex-4-ene-1,2-dicarboxylate

Base Information

• Chemical Name: 2,2-Dimethylpropane-1,3-diyl cyclohex-4-ene-1,2-dicarboxylate
• CAS No.: 41026-17-9
• Molecular Formula: C21H28 O8
• Molecular Weight: 238.27962
• European Community (EC) Number: 255-180-5
• Mol file: 41026-17-9.mol

Synonyms:41026-17-9;EINECS 255-180-5;2,2-Dimethylpropane-1,3-diyl cyclohex-4-ene-1,2-dicarboxylate;4,4-dimethyl-3,5,7a,8,11,11a-hexahydro-2,6-benzodioxonine-1,7-dione;EC 255-180-5;W-110944;4-Cyclohexene-1,2-dicarboxylic acid, 2,2-dimethyl-1,3-propanediyl ester

Chemical Property of 2,2-Dimethylpropane-1,3-diyl cyclohex-4-ene-1,2-dicarboxylate

Chemical Property:

• Vapor Pressure: 9.89E-08mmHg at 25°C
• Boiling Point: 433.9°Cat760mmHg
• PKA: 4.55[at 20 ℃]
• Flash Point: 225.3°C
• PSA: 52.60000
• Density: 1.09g/cm³
• LogP: 1.69500
• Water Solubility.: 236mg/L at 20℃
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 238.12050905
• Heavy Atom Count: 17
• Complexity: 324

Purity/Quality:

99.9% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1(COC(=O)C2CC=CCC2C(=O)OC1)C