1,3-Dioxan-4-one, 2-ethoxy-2,6-dimethyl-, (2S-trans)-

Base Information

• Chemical Name: 1,3-Dioxan-4-one, 2-ethoxy-2,6-dimethyl-, (2S-trans)-
• CAS No.: 114592-77-7
• Molecular Formula: C₈H₁₄O₄
• Molecular Weight: 174.197
• DSSTox Substance ID: DTXSID801216084

Synonyms:SCHEMBL8609740;1,3-Dioxan-4-one, 2-ethoxy-2,6-dimethyl-, (2S-trans)-;DTXSID801216084;114592-77-7

Chemical Property of 1,3-Dioxan-4-one, 2-ethoxy-2,6-dimethyl-, (2S-trans)-

Chemical Property:

• XLogP3: 0.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 174.08920892
• Heavy Atom Count: 12
• Complexity: 180

Purity/Quality:

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CCOC1(OC(CC(=O)O1)C)C
• Isomeric SMILES: CCO[C@]1(O[C@@H](CC(=O)O1)C)C

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