Home
MCP
Workbench
Skills
More
English
English
Home
Workbench
Notifications
Me
Home
/
Compound
Ethyl 3-(5-fluoro-2-pyridinyl)prop-2-enoate
HCID
77251925
Save
Notes
Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
Substructure search
Find similar structures
Basic information
Standard SMILES
CCOC(=O)C=Cc1ccc(F)cn1
InChIKey
ZDVNYRLLKVVILK-UHFFFAOYSA-N
Molecular formula
C10H10FNO2
Average molar mass
195.19 g/mol
Monoisotopic mass
195.06955672
Names & identifiers
Preferred name
Ethyl 3-(5-fluoro-2-pyridinyl)prop-2-enoate
IUPAC
ethyl 3-(5-fluoro-2-pyridinyl)prop-2-enoate
Database identifiers
PubChem CID
77251925
Properties
Computed structural properties
XLogP
1.6
Topological polar surface area
39.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
14
Formal charge
0
Complexity
218
Show all 8
Show all 8 / 8
Related reactions
1 records
New reaction record
All
As reactant
As product
As reagent
As catalyst
As solvent
HRID
802617
As product
Test data from https://doi.org/10.1039/C8SC04228D
Compound notes
Loading…