2-benzyl-7-fluoronaphthalene

C17H13F — CID 54552488

IUPAC2-benzyl-7-fluoronaphthalene
SMILESFc1ccc2ccc(Cc3ccccc3)cc2c1
InChIInChI=1S/C17H13F/c18-17-9-8-15-7-6-14(11-16(15)12-17)10-13-4-2-1-3-5-13/h1-9,11-12H,10H2
InChIKeyQFQGHJXGEQMAON-UHFFFAOYSA-N
MW236.29 g/mol
LogP4.57
Rot. Bonds2

About 2-benzyl-7-fluoronaphthalene

2-benzyl-7-fluoronaphthalene (PubChem CID 54552488) has the molecular formula C17H13F and a molecular weight of 236.29 g/mol. Its IUPAC name is 2-benzyl-7-fluoronaphthalene.

Molecular Properties

Compound Name2-benzyl-7-fluoronaphthalene
PubChem CID54552488
Molecular FormulaC17H13F
Molecular Weight236.29 g/mol
Exact Mass236.10
IUPAC Name2-benzyl-7-fluoronaphthalene
SMILESFc1ccc2ccc(Cc3ccccc3)cc2c1
InChIInChI=1S/C17H13F/c18-17-9-8-15-7-6-14(11-16(15)12-17)10-13-4-2-1-3-5-13/h1-9,11-12H,10H2
InChIKeyQFQGHJXGEQMAON-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 2-benzyl-7-fluoronaphthalene?
The IUPAC name of 2-benzyl-7-fluoronaphthalene (CID 54552488) is 2-benzyl-7-fluoronaphthalene.
What is the SMILES notation for 2-benzyl-7-fluoronaphthalene?
The canonical SMILES for 2-benzyl-7-fluoronaphthalene is Fc1ccc2ccc(Cc3ccccc3)cc2c1.
What is the InChIKey of 2-benzyl-7-fluoronaphthalene?
The InChIKey is QFQGHJXGEQMAON-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13F/c18-17-9-8-15-7-6-14(11-16(15)12-17)10-13-4-2-1-3-5-13/h1-9,11-12H,10H2.
What are the key properties of 2-benzyl-7-fluoronaphthalene?
2-benzyl-7-fluoronaphthalene 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 2-benzyl-7-fluoronaphthalene is sourced from PubChem (CID 54552488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).