Basic information
- CAS
92930-03-5- Standard SMILES
CC(C)(C)C(=O)C=Cc1ccc(C2OCCO2)cc1- InChIKey
UCGMVQMYTNORTC-UHFFFAOYSA-N- Molecular formula
- C16H20O3
- Average molar mass
- 260.33 g/mol
- Monoisotopic mass
- 260.1412445
Names & identifiers
- Preferred name
- 1-[4-(1,3-Dioxolan-2-yl)phenyl]-4,4-dimethylpent-1-en-3-one
- IUPAC
- 1-[4-(1,3-dioxolan-2-yl)phenyl]-4,4-dimethylpent-1-en-3-one
Names & synonyms
92930-03-51-[4-(1,3-Dioxolan-2-yl)phenyl]-4,4-dimethylpent-1-en-3-oneSCHEMBL10740012DTXSID50710723UCGMVQMYTNORTC-UHFFFAOYSA-N4,4-dimethyl-1-[4-(1,3-dioxolan-2-yl)-phenyl]-1-penten-3-one4,4-dimethyl-1-[4-(1,3-dioxolan-2-yl)phenyl]-1-penten-3-one
Database identifiers
- CAS
92930-03-5- PubChem CID
- 54345839
- DTXSID
DTXSID50710723
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 326
Related reactions
5 records
Compound notes
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