Basic information
- CAS
905966-49-6- Standard SMILES
COc1ccc(/C=C/B2OCC(C)(C)CO2)cc1- InChIKey
CSWLMFQLNHNHFY-CMDGGOBGSA-N- Molecular formula
- C14H19BO3
- Average molar mass
- 246.11 g/mol
- Monoisotopic mass
- 246.1427246
Names & identifiers
- Preferred name
- 2-((1E)-2-(4-Methoxyphenyl)ethenyl)-5,5-dimethyl-1,3,2-dioxaborinane
- IUPAC
- 2-[(E)-2-(4-methoxyphenyl)ethenyl]-5,5-dimethyl-1,3,2-dioxaborinane
Names & synonyms
905966-49-62-[(1E)-2-(4-Methoxyphenyl)ethenyl]-5,5-dimethyl-1,3,2-dioxaborinane2-((1E)-2-(4-Methoxyphenyl)ethenyl)-5,5-dimethyl-1,3,2-dioxaborinaneRefChem:249137(E)-2-(4-Methoxystyryl)-5,5-dimethyl-1,3,2-dioxaborinaneDTXSID9011584692-[(E)-2-(4-methoxyphenyl)ethenyl]-5,5-dimethyl-1,3,2-dioxaborinane
Database identifiers
- CAS
905966-49-6- PubChem CID
- 11622895
- DTXSID
DTXSID901158469- Nikkaji
- J1.880.443C、J2.473.332G
Properties
Computed structural properties
- Topological polar surface area
- 27.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 273
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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