Basic information
- CAS
51167-48-7- Standard SMILES
Oc1cc2c(cc1CC=Cc1ccccc1)OCO2- InChIKey
DRJMXFXDHQJEPO-UHFFFAOYSA-N- Molecular formula
- C16H14O3
- Average molar mass
- 254.28 g/mol
- Monoisotopic mass
- 254.0942943
Names & identifiers
- Preferred name
- 6-Cinnamylbenzo[1,3]dioxol-5-OL
- IUPAC
- 6-(3-phenylprop-2-enyl)-1,3-benzodioxol-5-ol
Names & synonyms
51167-48-76-CINNAMYLBENZO[1,3]DIOXOL-5-OLSCHEMBL14284019DTXSID303133326-(3-Phenylprop-2-en-1-yl)-2H-1,3-benzodioxol-5-ol
Database identifiers
- CAS
51167-48-7- PubChem CID
- 320673
- DTXSID
DTXSID30313332
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 309
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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