1,4-dioxane;hydrofluoride

C4H9FO2 — CID 67908528

IUPAC1,4-dioxane;hydrofluoride
SMILESC1COCCO1.F
InChIInChI=1S/C4H8O2.FH/c1-2-6-4-3-5-1;/h1-4H2;1H
InChIKeyFDBYXORVPVRQKN-UHFFFAOYSA-N
MW108.11 g/mol
LogP0.19
Rot. Bonds

About 1,4-dioxane;hydrofluoride

1,4-dioxane;hydrofluoride (PubChem CID 67908528) has the molecular formula C4H9FO2 and a molecular weight of 108.11 g/mol. Its IUPAC name is 1,4-dioxane;hydrofluoride.

Molecular Properties

Compound Name1,4-dioxane;hydrofluoride
PubChem CID67908528
Molecular FormulaC4H9FO2
Molecular Weight108.11 g/mol
Exact Mass108.06
IUPAC Name1,4-dioxane;hydrofluoride
SMILESC1COCCO1.F
InChIInChI=1S/C4H8O2.FH/c1-2-6-4-3-5-1;/h1-4H2;1H
InChIKeyFDBYXORVPVRQKN-UHFFFAOYSA-N
XLogP0.19
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.11
LogP ≤ 50.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,4-dioxane;hydrofluoride?
The IUPAC name of 1,4-dioxane;hydrofluoride (CID 67908528) is 1,4-dioxane;hydrofluoride.
What is the SMILES notation for 1,4-dioxane;hydrofluoride?
The canonical SMILES for 1,4-dioxane;hydrofluoride is C1COCCO1.F.
What is the InChIKey of 1,4-dioxane;hydrofluoride?
The InChIKey is FDBYXORVPVRQKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8O2.FH/c1-2-6-4-3-5-1;/h1-4H2;1H.
What are the key properties of 1,4-dioxane;hydrofluoride?
1,4-dioxane;hydrofluoride has a molecular weight of 108.11 g/mol, XLogP of 0.19, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dioxane;hydrofluoride is sourced from PubChem (CID 67908528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).