1-[(4-fluorophenyl)methyl]naphthalene

C17H13F — CID 11118033

IUPAC1-[(4-fluorophenyl)methyl]naphthalene
SMILESFc1ccc(Cc2cccc3ccccc23)cc1
InChIInChI=1S/C17H13F/c18-16-10-8-13(9-11-16)12-15-6-3-5-14-4-1-2-7-17(14)15/h1-11H,12H2
InChIKeyDMDKZNXKUVXXBA-UHFFFAOYSA-N
MW236.29 g/mol
LogP4.57
Rot. Bonds2

About 1-[(4-fluorophenyl)methyl]naphthalene

1-[(4-fluorophenyl)methyl]naphthalene (PubChem CID 11118033) has the molecular formula C17H13F and a molecular weight of 236.29 g/mol. Its IUPAC name is 1-[(4-fluorophenyl)methyl]naphthalene.

Molecular Properties

Compound Name1-[(4-fluorophenyl)methyl]naphthalene
PubChem CID11118033
Molecular FormulaC17H13F
Molecular Weight236.29 g/mol
Exact Mass236.10
IUPAC Name1-[(4-fluorophenyl)methyl]naphthalene
SMILESFc1ccc(Cc2cccc3ccccc23)cc1
InChIInChI=1S/C17H13F/c18-16-10-8-13(9-11-16)12-15-6-3-5-14-4-1-2-7-17(14)15/h1-11H,12H2
InChIKeyDMDKZNXKUVXXBA-UHFFFAOYSA-N
XLogP4.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.29
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-[(4-fluorophenyl)methyl]naphthalene?
The IUPAC name of 1-[(4-fluorophenyl)methyl]naphthalene (CID 11118033) is 1-[(4-fluorophenyl)methyl]naphthalene.
What is the SMILES notation for 1-[(4-fluorophenyl)methyl]naphthalene?
The canonical SMILES for 1-[(4-fluorophenyl)methyl]naphthalene is Fc1ccc(Cc2cccc3ccccc23)cc1.
What is the InChIKey of 1-[(4-fluorophenyl)methyl]naphthalene?
The InChIKey is DMDKZNXKUVXXBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13F/c18-16-10-8-13(9-11-16)12-15-6-3-5-14-4-1-2-7-17(14)15/h1-11H,12H2.
What are the key properties of 1-[(4-fluorophenyl)methyl]naphthalene?
1-[(4-fluorophenyl)methyl]naphthalene has a molecular weight of 236.29 g/mol, XLogP of 4.57, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-fluorophenyl)methyl]naphthalene is sourced from PubChem (CID 11118033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).