6,7-Dihydrooxepin-2(3H)-one

Base Information

• Chemical Name: 6,7-Dihydrooxepin-2(3H)-one
• CAS No.: 102575-06-4
• Molecular Formula: C6H8O2
• DSSTox Substance ID: DTXSID10568545
• Nikkaji Number: J1.438.508H
• Mol file: 102575-06-4.mol

Synonyms:6,7-Dihydrooxepin-2(3H)-one;102575-06-4;3-hexen-6-olide;SCHEMBL665218;DTXSID10568545

Chemical Property of 6,7-Dihydrooxepin-2(3H)-one

Chemical Property:

• XLogP3: 0.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 112.052429494
• Heavy Atom Count: 8
• Complexity: 116

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1COC(=O)CC=C1

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