Home
MCP
Workbench
Skills
More
English
English
Home
Workbench
Notifications
Me
2-(2,2-Diethoxyethoxy)-5-fluoropyrimidine (HCID 68427683)|Huagongshe
Home
/
Compound
2-(2,2-Diethoxyethoxy)-5-fluoropyrimidine
HCID
68427683
Save
Notes
Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
Substructure search
Find similar structures
Basic information
Standard SMILES
CCOC(COc1ncc(F)cn1)OCC
InChIKey
QSHLCCSWKPYGNE-UHFFFAOYSA-N
Molecular formula
C10H15FN2O3
Average molar mass
230.24 g/mol
Monoisotopic mass
230.10667051
Names & identifiers
Preferred name
2-(2,2-Diethoxyethoxy)-5-fluoropyrimidine
IUPAC
2-(2,2-diethoxyethoxy)-5-fluoropyrimidine
Names & synonyms
SCHEMBL2884266
QSHLCCSWKPYGNE-UHFFFAOYSA-N
2-(2,2-diethoxyethoxy)-5-fluoropyrimidine
Database identifiers
PubChem CID
68427683
Properties
Computed structural properties
XLogP
1.2
Topological polar surface area
53.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
7
Heavy atoms
16
Formal charge
0
Complexity
171
Show all 8
Show all 8 / 8
Related reactions
5 records
New reaction record
All
As reactant
As product
As reagent
As catalyst
As solvent
HRID
81628
As reactant
uspto-grants-2014_09
HRID
81629
As product
uspto-grants-2014_09
HRID
804743
As reactant
Test data from https://doi.org/10.1039/C8SC04228D
HRID
1517267
As reactant
uspto-grants-2012_07
HRID
1517268
As product
uspto-grants-2012_07
Show 1 more
Compound notes
Loading…