3,5-Dichloro-2,6-difluoro4-hydroxymethylpyridine

HCID 13985166

Notes Reactions

Substructure search Find similar structures

Basic information

Standard SMILES: OCc1c(Cl)c(F)nc(F)c1Cl
InChIKey: WCSUNYVLTWGGPC-UHFFFAOYSA-N
Molecular formula: C6H3Cl2F2NO
Average molar mass: 213.99 g/mol

Names & identifiers

Preferred name: 3,5-Dichloro-2,6-difluoro4-hydroxymethylpyridine
IUPAC: (3,5-dichloro-2,6-difluoro-4-pyridinyl)methanol

Names & synonyms

SCHEMBL10755280WCSUNYVLTWGGPC-UHFFFAOYSA-N3,5-dichloro-2,6-difluoro4-hydroxymethylpyridine

Database identifiers

PubChem CID: 13985166

Properties

Computed structural properties

XLogP: 2.1
Topological polar surface area: 33.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 1
Heavy atoms: 12
Formal charge: 0
Complexity: 148

Related reactions

6 records

New reaction record

HRID 163625 reaction equation

HRID 163625As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)

HRID 209343 reaction equation

HRID 209343As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)

HRID 256167 reaction equation

HRID 256167As productuspto-grants-1987_10

HRID 256168 reaction equation

HRID 256168As reactantuspto-grants-1987_10

HRID 256169 reaction equation

HRID 256169As reactantuspto-grants-1987_10

HRID 306168 reaction equation

HRID 306168As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)

Compound notes

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