3-Methoxybuta-1,3-dien-1-one

Base Information

• Chemical Name: 3-Methoxybuta-1,3-dien-1-one
• CAS No.: 132178-16-6
• Molecular Formula: C5H6O2
• Molecular Weight: 98.1014
• DSSTox Substance ID: DTXSID30572104
• Nikkaji Number: J702.774E

Synonyms:3-Methoxybuta-1,3-dien-1-one;132178-16-6;DTXSID30572104

Chemical Property of 3-Methoxybuta-1,3-dien-1-one

Chemical Property:

• XLogP3: 1.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 98.036779430
• Heavy Atom Count: 7
• Complexity: 109

Purity/Quality:

98%min ^*data from raw suppliers

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=C)C=C=O

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