Basic information
- Standard SMILES
CCOCc1cc(OC)c(OB(O)O)c(OC)c1- InChIKey
ZHESJXZIZCMRJA-UHFFFAOYSA-N- Molecular formula
- C11H17BO6
- Average molar mass
- 256.06 g/mol
- Monoisotopic mass
- 256.1118184
Names & identifiers
- Preferred name
- 2,6-Dimethoxy-4-(ethoxymethyl)phenylboric acid
- IUPAC
- [4-(ethoxymethyl)-2,6-dimethoxyphenoxy]boronic acid
Names & synonyms
2,6-dimethoxy-4-(ethoxymethyl)phenylboric acidSCHEMBL1021258ZHESJXZIZCMRJA-UHFFFAOYSA-NSB378334-ethoxymethyl-2,6-dimethoxyphenylboric acid
Database identifiers
- PubChem CID
- 23080950
Properties
Computed structural properties
- Topological polar surface area
- 77.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 214
Related reactions
2 records
Compound notes
Loading…