1-(2-fluoroethoxy)-4-(2-fluoroethoxymethyl)naphthalene

C15H16F2O2 — CID 15058752

IUPAC1-(2-fluoroethoxy)-4-(2-fluoroethoxymethyl)naphthalene
SMILESFCCOCc1ccc(OCCF)c2ccccc12
InChIInChI=1S/C15H16F2O2/c16-7-9-18-11-12-5-6-15(19-10-8-17)14-4-2-1-3-13(12)14/h1-6H,7-11H2
InChIKeyRNGIBQNCKDLZIX-UHFFFAOYSA-N
MW266.29 g/mol
LogP3.67
Rot. Bonds7

About 1-(2-fluoroethoxy)-4-(2-fluoroethoxymethyl)naphthalene

1-(2-fluoroethoxy)-4-(2-fluoroethoxymethyl)naphthalene (PubChem CID 15058752) has the molecular formula C15H16F2O2 and a molecular weight of 266.29 g/mol. Its IUPAC name is 1-(2-fluoroethoxy)-4-(2-fluoroethoxymethyl)naphthalene.

Molecular Properties

Compound Name1-(2-fluoroethoxy)-4-(2-fluoroethoxymethyl)naphthalene
PubChem CID15058752
Molecular FormulaC15H16F2O2
Molecular Weight266.29 g/mol
Exact Mass266.11
IUPAC Name1-(2-fluoroethoxy)-4-(2-fluoroethoxymethyl)naphthalene
SMILESFCCOCc1ccc(OCCF)c2ccccc12
InChIInChI=1S/C15H16F2O2/c16-7-9-18-11-12-5-6-15(19-10-8-17)14-4-2-1-3-13(12)14/h1-6H,7-11H2
InChIKeyRNGIBQNCKDLZIX-UHFFFAOYSA-N
XLogP3.67
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.29
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 1-(2-fluoroethoxy)-4-(2-fluoroethoxymethyl)naphthalene?
The IUPAC name of 1-(2-fluoroethoxy)-4-(2-fluoroethoxymethyl)naphthalene (CID 15058752) is 1-(2-fluoroethoxy)-4-(2-fluoroethoxymethyl)naphthalene.
What is the SMILES notation for 1-(2-fluoroethoxy)-4-(2-fluoroethoxymethyl)naphthalene?
The canonical SMILES for 1-(2-fluoroethoxy)-4-(2-fluoroethoxymethyl)naphthalene is FCCOCc1ccc(OCCF)c2ccccc12.
What is the InChIKey of 1-(2-fluoroethoxy)-4-(2-fluoroethoxymethyl)naphthalene?
The InChIKey is RNGIBQNCKDLZIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F2O2/c16-7-9-18-11-12-5-6-15(19-10-8-17)14-4-2-1-3-13(12)14/h1-6H,7-11H2.
What are the key properties of 1-(2-fluoroethoxy)-4-(2-fluoroethoxymethyl)naphthalene?
1-(2-fluoroethoxy)-4-(2-fluoroethoxymethyl)naphthalene has a molecular weight of 266.29 g/mol, XLogP of 3.67, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoroethoxy)-4-(2-fluoroethoxymethyl)naphthalene is sourced from PubChem (CID 15058752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).