Basic information
- Standard SMILES
CC1(C)OB(c2ccc(Oc3ccccc3)c(O)c2)OC1(C)C- InChIKey
QGVNDEJRDKOAPM-UHFFFAOYSA-N- Molecular formula
- C18H21BO4
- Average molar mass
- 312.2 g/mol
- Monoisotopic mass
- 312.1532893
Names & identifiers
- Preferred name
- 2-Phenoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol
- IUPAC
- 2-phenoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol
Names & synonyms
2-phenoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol1196396-01-6SCHEMBL1129150QGVNDEJRDKOAPM-UHFFFAOYSA-NCS-0105476D765412-Phenoxy-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenol
Database identifiers
- PubChem CID
- 66915535
Properties
Computed structural properties
- Topological polar surface area
- 47.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 390
Related reactions
2 records
Compound notes
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