Home
MCP
Workbench
Skills
More
English
English
Home
Workbench
Notifications
Me
Benzofuran-5-yl(pyridin-2-yl)methanol (HCID 58415302)|Huagongshe
Home
/
Compound
Benzofuran-5-yl(pyridin-2-yl)methanol
HCID
58415302
Save
Notes
Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
Substructure search
Find similar structures
Basic information
Standard SMILES
OC(c1ccc2occc2c1)c1ccccn1
InChIKey
ZAFXHNINZDFRTC-UHFFFAOYSA-N
Molecular formula
C14H11NO2
Average molar mass
225.24 g/mol
Monoisotopic mass
225.07897859
Names & identifiers
Preferred name
Benzofuran-5-yl(pyridin-2-yl)methanol
IUPAC
1-benzofuran-5-yl(pyridin-2-yl)methanol
Names & synonyms
SCHEMBL1602617
ZAFXHNINZDFRTC-UHFFFAOYSA-N
Benzofuran-5-yl(pyridin-2-yl)methanol
Database identifiers
PubChem CID
58415302
Properties
Computed structural properties
XLogP
2.1
Topological polar surface area
46.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
17
Formal charge
0
Complexity
259
Show all 8
Show all 8 / 8
Related reactions
4 records
New reaction record
All
As reactant
As product
As reagent
As catalyst
As solvent
HRID
318696
As product
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID
959743
As reactant
Validation data from https://doi.org/10.1039/C8SC04228D
HRID
2075201
As product
uspto-grants-2011_04
HRID
2075202
As reactant
uspto-grants-2011_04
Compound notes
Loading…