5-Butyl-2,2-dimethyl-1,3-dioxane-4,6-dione

Base Information

• Chemical Name: 5-Butyl-2,2-dimethyl-1,3-dioxane-4,6-dione
• CAS No.: 57742-51-5
• Molecular Formula: C10H16O4
• Molecular Weight: 200.235
• DSSTox Substance ID: DTXSID10453841
• Nikkaji Number: J3.338.371A
• Wikidata: Q82275104
• Mol file: 57742-51-5.mol

Synonyms:5-butyl-2,2-dimethyl-1,3-dioxane-4,6-dione;57742-51-5;SCHEMBL3784327;DTXSID10453841;COCRMIPMQVKKOZ-UHFFFAOYSA-N;2,2-Dimethyl-5-butyl-1,3-dioxane-4,6-dione

Chemical Property of 5-Butyl-2,2-dimethyl-1,3-dioxane-4,6-dione

Chemical Property:

• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 200.10485899
• Heavy Atom Count: 14
• Complexity: 225

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC1C(=O)OC(OC1=O)(C)C