Basic information
- CAS
6316-64-9- Standard SMILES
CC1OC(CCc2ccccc2)OC1C- InChIKey
IMENRMSTFPVGJX-UHFFFAOYSA-N- Molecular formula
- C13H18O2
- Average molar mass
- 206.28 g/mol
- Monoisotopic mass
- 206.13067981
Names & identifiers
- Preferred name
- 4,5-Dimethyl-2-(2-phenylethyl)-1,3-dioxolane
- IUPAC
- 4,5-dimethyl-2-(2-phenylethyl)-1,3-dioxolane
Names & synonyms
6316-64-94,5-dimethyl-2-(2-phenylethyl)-1,3-dioxolaneNSC22572DTXSID30281704NSC-22572
Database identifiers
- CAS
6316-64-9- PubChem CID
- 229147
- DTXSID
DTXSID30281704
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 177
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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