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2-Dimethylamino-4-hydroxymethyl-3,5,6-trifluoropyridine

HCID 13985164
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CN(C)c1nc(F)c(F)c(CO)c1F
InChIKey
HOHNHOYZRGIJHJ-UHFFFAOYSA-N
Molecular formula
C8H9F3N2O
Average molar mass
206.16 g/mol

Names & identifiers

Preferred name
2-Dimethylamino-4-hydroxymethyl-3,5,6-trifluoropyridine
IUPAC
[2-(dimethylamino)-3,5,6-trifluoro-4-pyridinyl]methanol

Names & synonyms

SCHEMBL10753907HOHNHOYZRGIJHJ-UHFFFAOYSA-N2-dimethylamino-4-hydroxymethyl-3,5,6-trifluoropyridine

Database identifiers

PubChem CID
13985164

Properties

Computed structural properties

XLogP
1.1
Topological polar surface area
36.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
2
Heavy atoms
14
Formal charge
0
Complexity
193

Related reactions

4 records
New reaction record
HRID 256163 reaction equation
HRID 256163As productuspto-grants-1987_10
HRID 256164 reaction equation
HRID 256164As reactantuspto-grants-1987_10
HRID 818625 reaction equation
HRID 818625As productTest data from https://doi.org/10.1039/C8SC04228D
HRID 822385 reaction equation
HRID 822385As reactantTest data from https://doi.org/10.1039/C8SC04228D

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes