CID 12574805

Base Information

• Chemical Name: CID 12574805
• CAS No.: 22377-44-2
• Molecular Formula: C6H8O2
• Molecular Weight: 112.128
• DSSTox Substance ID: DTXSID201293066
• Nikkaji Number: J874.217K
• Mol file: 22377-44-2.mol

Synonyms:22377-44-2;SCHEMBL15781972;DTXSID201293066;2,3-Pentadienoic acid, methyl ester

Chemical Property of CID 12574805

Chemical Property:

• XLogP3: 0.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 112.052429494
• Heavy Atom Count: 8
• Complexity: 130

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MSDS Files:

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• Canonical SMILES: CC=C=CC(=O)OC

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