2-[3-(3-fluorophenoxy)phenyl]-1,3-dioxolane

C15H13FO3 — CID 21071411

IUPAC2-[3-(3-fluorophenoxy)phenyl]-1,3-dioxolane
SMILESFc1cccc(Oc2cccc(C3OCCO3)c2)c1
InChIInChI=1S/C15H13FO3/c16-12-4-2-6-14(10-12)19-13-5-1-3-11(9-13)15-17-7-8-18-15/h1-6,9-10,15H,7-8H2
InChIKeyJZCBORZPOSQFMB-UHFFFAOYSA-N
MW260.26 g/mol
LogP3.66
Rot. Bonds3

About 2-[3-(3-fluorophenoxy)phenyl]-1,3-dioxolane

2-[3-(3-fluorophenoxy)phenyl]-1,3-dioxolane (PubChem CID 21071411) has the molecular formula C15H13FO3 and a molecular weight of 260.26 g/mol. Its IUPAC name is 2-[3-(3-fluorophenoxy)phenyl]-1,3-dioxolane.

Molecular Properties

Compound Name2-[3-(3-fluorophenoxy)phenyl]-1,3-dioxolane
PubChem CID21071411
Molecular FormulaC15H13FO3
Molecular Weight260.26 g/mol
Exact Mass260.08
IUPAC Name2-[3-(3-fluorophenoxy)phenyl]-1,3-dioxolane
SMILESFc1cccc(Oc2cccc(C3OCCO3)c2)c1
InChIInChI=1S/C15H13FO3/c16-12-4-2-6-14(10-12)19-13-5-1-3-11(9-13)15-17-7-8-18-15/h1-6,9-10,15H,7-8H2
InChIKeyJZCBORZPOSQFMB-UHFFFAOYSA-N
XLogP3.66
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.26
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-(4-fluorophenoxy)phenyl]-1,3-dioxolane
CID 67442762
2-(3-methoxyphenyl)-1,3-dioxolane
CID 11062994
[2-(3-fluorophenyl)-1,3-dioxan-5-yl]phosphane
CID 144750107
1,4-bis[3-(3-fluorophenoxy)phenoxy]benzene
CID 22338391
1-fluoro-3-(3-iodophenoxy)benzene
CID 118960389
2-(3-ethynylphenyl)-1,3-dioxolane
CID 19897393
2-(3-fluorophenyl)-5-propyl-1,3-dioxane
CID 54244668
1-fluoro-3-(3-fluorophenoxy)-5-methylbenzene
CID 54548242
tert-butyl-[3-(1,3-dioxan-2-yl)phenoxy]-dimethylsilane
CID 11358363
(1R,4S,5S,6R)-6-[4-(3-fluorophenoxy)phenyl]-4-phenyl-3-oxabicyclo[3.1.0]hexane-1-carbonitrile
CID 132502264
4-(chloromethyl)-2-(3-fluorophenyl)-1,3-dioxolane
CID 82776808
2-[[3-(1,3-dioxolan-2-yl)phenoxy]methyl]quinoline
CID 19864853

Frequently Asked Questions

What is the IUPAC name of 2-[3-(3-fluorophenoxy)phenyl]-1,3-dioxolane?
The IUPAC name of 2-[3-(3-fluorophenoxy)phenyl]-1,3-dioxolane (CID 21071411) is 2-[3-(3-fluorophenoxy)phenyl]-1,3-dioxolane.
What is the SMILES notation for 2-[3-(3-fluorophenoxy)phenyl]-1,3-dioxolane?
The canonical SMILES for 2-[3-(3-fluorophenoxy)phenyl]-1,3-dioxolane is Fc1cccc(Oc2cccc(C3OCCO3)c2)c1.
What is the InChIKey of 2-[3-(3-fluorophenoxy)phenyl]-1,3-dioxolane?
The InChIKey is JZCBORZPOSQFMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FO3/c16-12-4-2-6-14(10-12)19-13-5-1-3-11(9-13)15-17-7-8-18-15/h1-6,9-10,15H,7-8H2.
What are the key properties of 2-[3-(3-fluorophenoxy)phenyl]-1,3-dioxolane?
2-[3-(3-fluorophenoxy)phenyl]-1,3-dioxolane has a molecular weight of 260.26 g/mol, XLogP of 3.66, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(3-fluorophenoxy)phenyl]-1,3-dioxolane is sourced from PubChem (CID 21071411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).