2-(2-Benzyloxyethoxy)-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)pyridine (HCID 59620026)

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Basic information

Standard SMILES: CC1(C)OB(c2ccc(OCCOCc3ccccc3)nc2)OC1(C)C
InChIKey: RCPAREDLESCWOU-UHFFFAOYSA-N
Molecular formula: C20H26BNO4
Average molar mass: 355.2 g/mol

Names & identifiers

Preferred name: 2-(2-Benzyloxyethoxy)-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)pyridine
IUPAC: 2-(2-phenylmethoxyethoxy)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine

Names & synonyms

2-(2-benzyloxyethoxy)-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)pyridine1208536-70-2SCHEMBL2067941RCPAREDLESCWOU-UHFFFAOYSA-NDB-3375012-(2-benzyloxy-ethoxy)-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-pyridine

Database identifiers

PubChem CID: 59620026

Properties

Computed structural properties

Topological polar surface area: 49.8 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 5
Rotatable bonds: 7
Heavy atoms: 26
Formal charge: 0
Complexity: 424

Related reactions

2 records

New reaction record

HRID 86727As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

HRID 445564As reactantuspto-grants-2013_07

Compound notes

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