Home
MCP
Workbench
Skills
More
English
English
Home
Workbench
Notifications
Me
Home
/
Compound
5-Azido-2-benzhydryloxane
HCID
73009162
Save
Notes
Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
Substructure search
Find similar structures
Basic information
Standard SMILES
[N-]=[N+]=NC1CCC(C(c2ccccc2)c2ccccc2)OC1
InChIKey
KPEUKFKMSKJSSD-UHFFFAOYSA-N
Molecular formula
C18H19N3O
Average molar mass
293.4 g/mol
Monoisotopic mass
293.15281224
Names & identifiers
Preferred name
5-Azido-2-benzhydryloxane
IUPAC
5-azido-2-benzhydryloxane
Names & synonyms
SCHEMBL14145291
Database identifiers
PubChem CID
73009162
Properties
Computed structural properties
XLogP
5
Topological polar surface area
23.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
22
Formal charge
0
Complexity
364
Show all 8
Show all 8 / 8
Related reactions
2 records
New reaction record
All
As reactant
As product
As reagent
As catalyst
As solvent
HRID
209112
As product
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID
673679
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Compound notes
Loading…