6-[4-[2-[2-(2-fluoroethoxy)ethoxy]ethoxy]phenyl]naphthalen-2-ol

C22H23FO4 — CID 25112991

IUPAC6-[4-[2-[2-(2-fluoroethoxy)ethoxy]ethoxy]phenyl]naphthalen-2-ol
SMILESOc1ccc2cc(-c3ccc(OCCOCCOCCF)cc3)ccc2c1
InChIInChI=1S/C22H23FO4/c23-9-10-25-11-12-26-13-14-27-22-7-4-17(5-8-22)18-1-2-20-16-21(24)6-3-19(20)15-18/h1-8,15-16,24H,9-14H2
InChIKeySNEABMFYILIWTH-UHFFFAOYSA-N
MW370.42 g/mol
LogP4.59
Rot. Bonds10

About 6-[4-[2-[2-(2-fluoroethoxy)ethoxy]ethoxy]phenyl]naphthalen-2-ol

6-[4-[2-[2-(2-fluoroethoxy)ethoxy]ethoxy]phenyl]naphthalen-2-ol (PubChem CID 25112991) has the molecular formula C22H23FO4 and a molecular weight of 370.42 g/mol. Its IUPAC name is 6-[4-[2-[2-(2-fluoroethoxy)ethoxy]ethoxy]phenyl]naphthalen-2-ol.

Molecular Properties

Compound Name6-[4-[2-[2-(2-fluoroethoxy)ethoxy]ethoxy]phenyl]naphthalen-2-ol
PubChem CID25112991
Molecular FormulaC22H23FO4
Molecular Weight370.42 g/mol
Exact Mass370.16
IUPAC Name6-[4-[2-[2-(2-fluoroethoxy)ethoxy]ethoxy]phenyl]naphthalen-2-ol
SMILESOc1ccc2cc(-c3ccc(OCCOCCOCCF)cc3)ccc2c1
InChIInChI=1S/C22H23FO4/c23-9-10-25-11-12-26-13-14-27-22-7-4-17(5-8-22)18-1-2-20-16-21(24)6-3-19(20)15-18/h1-8,15-16,24H,9-14H2
InChIKeySNEABMFYILIWTH-UHFFFAOYSA-N
XLogP4.59
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.42
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-[4-[2-[2-(2-fluoroethoxy)ethoxy]ethoxy]phenyl]naphthalen-2-ol?
The IUPAC name of 6-[4-[2-[2-(2-fluoroethoxy)ethoxy]ethoxy]phenyl]naphthalen-2-ol (CID 25112991) is 6-[4-[2-[2-(2-fluoroethoxy)ethoxy]ethoxy]phenyl]naphthalen-2-ol.
What is the SMILES notation for 6-[4-[2-[2-(2-fluoroethoxy)ethoxy]ethoxy]phenyl]naphthalen-2-ol?
The canonical SMILES for 6-[4-[2-[2-(2-fluoroethoxy)ethoxy]ethoxy]phenyl]naphthalen-2-ol is Oc1ccc2cc(-c3ccc(OCCOCCOCCF)cc3)ccc2c1.
What is the InChIKey of 6-[4-[2-[2-(2-fluoroethoxy)ethoxy]ethoxy]phenyl]naphthalen-2-ol?
The InChIKey is SNEABMFYILIWTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23FO4/c23-9-10-25-11-12-26-13-14-27-22-7-4-17(5-8-22)18-1-2-20-16-21(24)6-3-19(20)15-18/h1-8,15-16,24H,9-14H2.
What are the key properties of 6-[4-[2-[2-(2-fluoroethoxy)ethoxy]ethoxy]phenyl]naphthalen-2-ol?
6-[4-[2-[2-(2-fluoroethoxy)ethoxy]ethoxy]phenyl]naphthalen-2-ol has a molecular weight of 370.42 g/mol, XLogP of 4.59, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-[2-[2-(2-fluoroethoxy)ethoxy]ethoxy]phenyl]naphthalen-2-ol is sourced from PubChem (CID 25112991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).