2-(2-Methoxyphenyl)-1,3-dioxane
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Basic information
- CAS
13309-95-0- Standard SMILES
COc1ccccc1C1OCCCO1- InChIKey
NIVJIFNSJCMTQY-UHFFFAOYSA-N- Molecular formula
- C11H14O3
- Average molar mass
- 194.23 g/mol
- Monoisotopic mass
- 194.0942943
Names & identifiers
- Preferred name
- 2-(2-Methoxyphenyl)-1,3-dioxane
- IUPAC
- 2-(2-methoxyphenyl)-1,3-dioxane
- English name
- 1,3-Dioxane,2-(2-methoxyphenyl)-(9CI)
- Molecular formula
- C11H14O3
- Molecular weight
- 194.23
Names & synonyms
13309-95-02-(2-Methoxyphenyl)-1,3-dioxane2-(2-Methoxyphenyl)-[1,3]-dioxane1,3-Dioxane,2-(2-methoxyphenyl)-(9CI)SCHEMBL5801397SCHEMBL9826178NIVJIFNSJCMTQY-UHFFFAOYSA-NAKOS0062796811,3-Dioxane, 2-(2-methoxyphenyl)-2-(2-Methoxy-phenyl)-[1,3]-dioxaneDB-267514
Database identifiers
- CAS
13309-95-0- PubChem CID
- 12964157
- Nikkaji
- J2.091.976K
Properties
Computed structural propertiesFilling in
- XLogP
- 1.7
- Topological polar surface area
- 27.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 166
Related reactions
0 records
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Compound notes
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