2,3-Difluoro4-(4-pentyloxybutoxy)phenylboronic acid

HCID 22016255
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Basic information

Standard SMILES
CCCCCOCCCCOc1ccc(B(O)O)c(F)c1F
InChIKey
NVMLIGCYWJXTGO-UHFFFAOYSA-N
Molecular formula
C15H23BF2O4
Average molar mass
316.15 g/mol

Names & identifiers

Preferred name
2,3-Difluoro4-(4-pentyloxybutoxy)phenylboronic acid
IUPAC
[2,3-difluoro-4-(4-pentoxybutoxy)phenyl]boronic acid

Names & synonyms

SCHEMBL6000401NVMLIGCYWJXTGO-UHFFFAOYSA-N2,3-Difluoro4-(4-pentyloxybutoxy)phenylboronic acid2,3-Difluoro-4-(4-pentyloxybutoxy)phenylboronic acid402860-16-6

Database identifiers

PubChem CID
22016255

Properties

Computed structural properties

Topological polar surface area
58.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
11
Heavy atoms
22

Related reactions

4 records
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Linked notes

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