2-(1-fluoroethenyl)naphthalene

C12H9F — CID 57382626

IUPAC2-(1-fluoroethenyl)naphthalene
SMILESC=C(F)c1ccc2ccccc2c1
InChIInChI=1S/C12H9F/c1-9(13)11-7-6-10-4-2-3-5-12(10)8-11/h2-8H,1H2
InChIKeyIYCYCIDUCGCQKN-UHFFFAOYSA-N
MW172.20 g/mol
LogP3.78
Rot. Bonds1

About 2-(1-fluoroethenyl)naphthalene

2-(1-fluoroethenyl)naphthalene (PubChem CID 57382626) has the molecular formula C12H9F and a molecular weight of 172.20 g/mol. Its IUPAC name is 2-(1-fluoroethenyl)naphthalene.

Molecular Properties

Compound Name2-(1-fluoroethenyl)naphthalene
PubChem CID57382626
Molecular FormulaC12H9F
Molecular Weight172.20 g/mol
Exact Mass172.07
IUPAC Name2-(1-fluoroethenyl)naphthalene
SMILESC=C(F)c1ccc2ccccc2c1
InChIInChI=1S/C12H9F/c1-9(13)11-7-6-10-4-2-3-5-12(10)8-11/h2-8H,1H2
InChIKeyIYCYCIDUCGCQKN-UHFFFAOYSA-N
XLogP3.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.20
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-(1-fluoroethenyl)naphthalene?
The IUPAC name of 2-(1-fluoroethenyl)naphthalene (CID 57382626) is 2-(1-fluoroethenyl)naphthalene.
What is the SMILES notation for 2-(1-fluoroethenyl)naphthalene?
The canonical SMILES for 2-(1-fluoroethenyl)naphthalene is C=C(F)c1ccc2ccccc2c1.
What is the InChIKey of 2-(1-fluoroethenyl)naphthalene?
The InChIKey is IYCYCIDUCGCQKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9F/c1-9(13)11-7-6-10-4-2-3-5-12(10)8-11/h2-8H,1H2.
What are the key properties of 2-(1-fluoroethenyl)naphthalene?
2-(1-fluoroethenyl)naphthalene has a molecular weight of 172.20 g/mol, XLogP of 3.78, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-fluoroethenyl)naphthalene is sourced from PubChem (CID 57382626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).