HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program：[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

3-(4-Ethoxy-2-fluoro-phenoxy)-azetidine

HCID 86689018
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOc1ccc(OC2CNC2)c(F)c1
InChIKey
AQWZLONCOLHYON-UHFFFAOYSA-N
Molecular formula
C11H14FNO2
Average molar mass
211.23 g/mol

Names & identifiers

Preferred name
3-(4-Ethoxy-2-fluoro-phenoxy)-azetidine
IUPAC
3-(4-ethoxy-2-fluorophenoxy)azetidine

Names & synonyms

SCHEMBL15064686AQWZLONCOLHYON-UHFFFAOYSA-N3-(4-ethoxy-2-fluoro-phenoxy)-azetidine

Database identifiers

PubChem CID
86689018

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
30.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
15
Formal charge
0
Complexity
199

Related reactions

4 records
New reaction record
HRID 40517 reaction equation
HRID 40517As reactantuspto-grants-2013_09
HRID 40518 reaction equation
HRID 40518As reactantuspto-grants-2013_09
HRID 2321629 reaction equation
HRID 2321629As reactantTraining data from https://doi.org/10.1039/C8SC04228D (10/10)
HRID 2350304 reaction equation
HRID 2350304As reactantTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes