HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

2-[4-(2,3-Difluorophenoxy)butoxy]-tetrahydropyran

HCID 22016256
New noteNew reactionRequest quotes
Print preview

Completing data — refresh the page later to see the latest

Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Fc1cccc(OCCCCOC2CCCCO2)c1F
InChIKey
DHMVCDMUSQWUQM-UHFFFAOYSA-N
Molecular formula
C15H20F2O3
Average molar mass
286.31 g/mol

Names & identifiers

Preferred name
2-[4-(2,3-Difluorophenoxy)butoxy]-tetrahydropyran
IUPAC
2-[4-(2,3-difluorophenoxy)butoxy]oxane

Names & synonyms

SCHEMBL6000386DHMVCDMUSQWUQM-UHFFFAOYSA-N2-[4-(2,3-Difluorophenoxy)butoxy]-tetrahydropyran2-[4-(2,3-Difluorophenoxy)-butoxy]-tetrahydropyran

Database identifiers

PubChem CID
22016256

Properties

Computed structural propertiesFilling in

XLogP
3.5
Topological polar surface area
27.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
7
Heavy atoms
20
Formal charge
0
Complexity
266

Related reactions

3 records
New reaction record
HRID 6589 reaction equation
HRID 6589As reactantuspto-grants-2006_08
HRID 6595 reaction equation
HRID 6595As reactantuspto-grants-2006_08
HRID 950647 reaction equation
HRID 950647As reactantValidation data from https://doi.org/10.1039/C8SC04228D

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes