6-[(2,4-Dimethoxyphenyl)-methoxymethyl]-1,3-benzodioxol-5-ol
Basic information
- CAS
299421-05-9- Standard SMILES
COc1ccc(C(OC)c2cc3c(cc2O)OCO3)c(OC)c1- InChIKey
YIUNQRWXHUBPIF-UHFFFAOYSA-N- Molecular formula
- C17H18O6
- Average molar mass
- 318.32 g/mol
- Monoisotopic mass
- 318.11033829
Names & identifiers
- Preferred name
- 6-[(2,4-Dimethoxyphenyl)-methoxymethyl]-1,3-benzodioxol-5-ol
- IUPAC
- 6-[(2,4-dimethoxyphenyl)-methoxymethyl]-1,3-benzodioxol-5-ol
Names & synonyms
6-[(2,4-dimethoxyphenyl)-methoxymethyl]-1,3-benzodioxol-5-olAKOS024325598ST504480846-((2,4-DIMETHOXY-PHENYL)-METHOXY-METHYL)-BENZO(1,3)DIOXOL-5-OL
Database identifiers
- CAS
299421-05-9- PubChem CID
- 4581905
- EC Number
- 148-530-2
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 378
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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