1,3-Benzodioxole-5-carboxylic acid, 2,2-dimethyl-, methyl ester

Base Information

• Chemical Name: 1,3-Benzodioxole-5-carboxylic acid, 2,2-dimethyl-, methyl ester
• CAS No.: 88517-56-0
• Molecular Formula: C11H12O4
• Molecular Weight: 208.214
• DSSTox Substance ID: DTXSID00443731
• Wikidata: Q82261673

Synonyms:88517-56-0;1,3-Benzodioxole-5-carboxylic acid, 2,2-dimethyl-, methyl ester;SCHEMBL24401018;DTXSID00443731

Chemical Property of 1,3-Benzodioxole-5-carboxylic acid, 2,2-dimethyl-, methyl ester

Chemical Property:

• PSA: 44.76000
• LogP: 1.98050
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 208.07355886
• Heavy Atom Count: 15
• Complexity: 261

Purity/Quality:

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CC1(OC2=C(O1)C=C(C=C2)C(=O)OC)C

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