1-Methoxy-3-buten-2-one

Base Information

• Chemical Name: 1-Methoxy-3-buten-2-one
• CAS No.: 43042-58-6
• Molecular Formula: C₅H₈O₂
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID70415662
• Nikkaji Number: J1.386.013K
• Wikidata: Q82224623
• Mol file: 43042-58-6.mol

Synonyms:1-methoxybut-3-en-2-one;1-METHOXY-3-BUTEN-2-ONE;43042-58-6;Methoxybutenon;ghl.PD_Mitscher_leg0.687;1-Methoxy-3-butene-2-one;SCHEMBL3832321;DTXSID70415662;AKOS014316165;EN300-697532

Chemical Property of 1-Methoxy-3-buten-2-one

Chemical Property:

• XLogP3: 0.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 100.052429494
• Heavy Atom Count: 7
• Complexity: 76.1

Purity/Quality:

99% ^*data from raw suppliers

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• Canonical SMILES: COCC(=O)C=C

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