1-fluoro-3-[methoxy(diphenyl)methyl]benzene

C20H17FO — CID 15680512

IUPAC1-fluoro-3-[methoxy(diphenyl)methyl]benzene
SMILESCOC(c1ccccc1)(c1ccccc1)c1cccc(F)c1
InChIInChI=1S/C20H17FO/c1-22-20(16-9-4-2-5-10-16,17-11-6-3-7-12-17)18-13-8-14-19(21)15-18/h2-15H,1H3
InChIKeyFEEBSKITVWMWBI-UHFFFAOYSA-N
MW292.35 g/mol
LogP4.76
Rot. Bonds4

About 1-fluoro-3-[methoxy(diphenyl)methyl]benzene

1-fluoro-3-[methoxy(diphenyl)methyl]benzene (PubChem CID 15680512) has the molecular formula C20H17FO and a molecular weight of 292.35 g/mol. Its IUPAC name is 1-fluoro-3-[methoxy(diphenyl)methyl]benzene.

Molecular Properties

Compound Name1-fluoro-3-[methoxy(diphenyl)methyl]benzene
PubChem CID15680512
Molecular FormulaC20H17FO
Molecular Weight292.35 g/mol
Exact Mass292.13
IUPAC Name1-fluoro-3-[methoxy(diphenyl)methyl]benzene
SMILESCOC(c1ccccc1)(c1ccccc1)c1cccc(F)c1
InChIInChI=1S/C20H17FO/c1-22-20(16-9-4-2-5-10-16,17-11-6-3-7-12-17)18-13-8-14-19(21)15-18/h2-15H,1H3
InChIKeyFEEBSKITVWMWBI-UHFFFAOYSA-N
XLogP4.76
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.35
LogP ≤ 54.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-fluoro-3-[methoxy(diphenyl)methyl]benzene?
The IUPAC name of 1-fluoro-3-[methoxy(diphenyl)methyl]benzene (CID 15680512) is 1-fluoro-3-[methoxy(diphenyl)methyl]benzene.
What is the SMILES notation for 1-fluoro-3-[methoxy(diphenyl)methyl]benzene?
The canonical SMILES for 1-fluoro-3-[methoxy(diphenyl)methyl]benzene is COC(c1ccccc1)(c1ccccc1)c1cccc(F)c1.
What is the InChIKey of 1-fluoro-3-[methoxy(diphenyl)methyl]benzene?
The InChIKey is FEEBSKITVWMWBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17FO/c1-22-20(16-9-4-2-5-10-16,17-11-6-3-7-12-17)18-13-8-14-19(21)15-18/h2-15H,1H3.
What are the key properties of 1-fluoro-3-[methoxy(diphenyl)methyl]benzene?
1-fluoro-3-[methoxy(diphenyl)methyl]benzene has a molecular weight of 292.35 g/mol, XLogP of 4.76, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-3-[methoxy(diphenyl)methyl]benzene is sourced from PubChem (CID 15680512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).