Basic information
- Standard SMILES
C1COCCO1.CCO.O- InChIKey
AHQTYUNPLZYCOL-UHFFFAOYSA-N- Molecular formula
- C6H16O4
- Average molar mass
- 152.19 g/mol
Names & identifiers
- Preferred name
- Dioxane ethanol water
- IUPAC
- 1,4-dioxane;ethanol;hydrate
Names & synonyms
dioxane EtOH waterdioxane EtOH H2Odioxane H2O EtOHEtOH dioxane H2Odioxane ethanol waterdioxane water ethanolethanol dioxane waterethanol water dioxaneSCHEMBL4586354AHQTYUNPLZYCOL-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 69104347
Properties
Computed structural properties
- Topological polar surface area
- 39.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 29.3
Related reactions
14 records
Compound notes
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