2-(2-fluoroethyl)naphthalene

C12H11F — CID 58999466

IUPAC2-(2-fluoroethyl)naphthalene
SMILESFCCc1ccc2ccccc2c1
InChIInChI=1S/C12H11F/c13-8-7-10-5-6-11-3-1-2-4-12(11)9-10/h1-6,9H,7-8H2
InChIKeyOVVGIPSPLCRCPZ-UHFFFAOYSA-N
MW174.22 g/mol
LogP3.35
Rot. Bonds2

About 2-(2-fluoroethyl)naphthalene

2-(2-fluoroethyl)naphthalene (PubChem CID 58999466) has the molecular formula C12H11F and a molecular weight of 174.22 g/mol. Its IUPAC name is 2-(2-fluoroethyl)naphthalene.

Molecular Properties

Compound Name2-(2-fluoroethyl)naphthalene
PubChem CID58999466
Molecular FormulaC12H11F
Molecular Weight174.22 g/mol
Exact Mass174.08
IUPAC Name2-(2-fluoroethyl)naphthalene
SMILESFCCc1ccc2ccccc2c1
InChIInChI=1S/C12H11F/c13-8-7-10-5-6-11-3-1-2-4-12(11)9-10/h1-6,9H,7-8H2
InChIKeyOVVGIPSPLCRCPZ-UHFFFAOYSA-N
XLogP3.35
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.22
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoroethyl)naphthalene?
The IUPAC name of 2-(2-fluoroethyl)naphthalene (CID 58999466) is 2-(2-fluoroethyl)naphthalene.
What is the SMILES notation for 2-(2-fluoroethyl)naphthalene?
The canonical SMILES for 2-(2-fluoroethyl)naphthalene is FCCc1ccc2ccccc2c1.
What is the InChIKey of 2-(2-fluoroethyl)naphthalene?
The InChIKey is OVVGIPSPLCRCPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11F/c13-8-7-10-5-6-11-3-1-2-4-12(11)9-10/h1-6,9H,7-8H2.
What are the key properties of 2-(2-fluoroethyl)naphthalene?
2-(2-fluoroethyl)naphthalene has a molecular weight of 174.22 g/mol, XLogP of 3.35, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoroethyl)naphthalene is sourced from PubChem (CID 58999466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).