2H-1,3-Benzodioxol-5-yl 3-methylbut-2-enoate

Base Information

• Chemical Name: 2H-1,3-Benzodioxol-5-yl 3-methylbut-2-enoate
• CAS No.: 112979-30-3
• Molecular Formula: C12H12O4
• Molecular Weight: 220.225
• DSSTox Substance ID: DTXSID90567930
• Nikkaji Number: J2.861.232J

Synonyms:112979-30-3;2H-1,3-Benzodioxol-5-yl 3-methylbut-2-enoate;SCHEMBL26500688;DTXSID90567930

Chemical Property of 2H-1,3-Benzodioxol-5-yl 3-methylbut-2-enoate

Chemical Property:

• XLogP3: 2.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 220.07355886
• Heavy Atom Count: 16
• Complexity: 293

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=CC(=O)OC1=CC2=C(C=C1)OCO2)C

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