Basic information
- CAS
22644-56-0- Standard SMILES
CCC1(C(C)OC)COC(C)OC1- InChIKey
BEOAGXKTCHJHLT-UHFFFAOYSA-N- Molecular formula
- C10H20O3
- Average molar mass
- 188.26 g/mol
- Monoisotopic mass
- 188.1412445
Names & identifiers
- Preferred name
- 5-Ethyl-5-(1-methoxyethyl)-2-methyl-1,3-dioxane
- IUPAC
- 5-ethyl-5-(1-methoxyethyl)-2-methyl-1,3-dioxane
- English name
- 5β-Ethyl-5α-(1-methoxyethyl)-2β-methyl-1,3-dioxane
- Molecular formula
- C10H20O3
- Molecular weight
- 188.265
Names & synonyms
5-ethyl-5-(1-methoxyethyl)-2-methyl-1,3-dioxane22644-56-0DTXSID40945305RefChem:1072891DTXCID70137362522644-57-1m-DIOXANE, 5-ETHYL-5-(1-METHOXYETHYL)-2-METHYL-, (Z)-5alpha-Ethyl-5beta-(1-methoxyethyl)-2beta-methyl-1,3-dioxanecis-5-Ethyl-5-(1-methoxyethyl)-2-methyl-1,3-dioxanetrans-5-Ethyl-5-(1-methoxyethyl)-2-methyl-1,3-dioxanestarbld0041757m-DIOXANE, 5-ETHYL-5-(1-METHOXYETHYL)-2-METHYL-, (E)-
Database identifiers
- CAS
22644-56-0、22644-57-1- PubChem CID
- 31452
- DTXSID
DTXSID40945305- Nikkaji
- J73.736D、J73.737B
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 27.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 150
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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