argon;1,4-dioxane

C4H8ArO2 — CID 87641547

IUPACargon;1,4-dioxane
SMILESC1COCCO1.[Ar]
InChIInChI=1S/C4H8O2.Ar/c1-2-6-4-3-5-1;/h1-4H2;
InChIKeyKQKIWKBZIQGNEO-UHFFFAOYSA-N
MW128.05 g/mol
LogP0.03
Rot. Bonds

About argon;1,4-dioxane

argon;1,4-dioxane (PubChem CID 87641547) has the molecular formula C4H8ArO2 and a molecular weight of 128.05 g/mol. Its IUPAC name is argon;1,4-dioxane.

Molecular Properties

Compound Nameargon;1,4-dioxane
PubChem CID87641547
Molecular FormulaC4H8ArO2
Molecular Weight128.05 g/mol
Exact Mass128.01
IUPAC Nameargon;1,4-dioxane
SMILESC1COCCO1.[Ar]
InChIInChI=1S/C4H8O2.Ar/c1-2-6-4-3-5-1;/h1-4H2;
InChIKeyKQKIWKBZIQGNEO-UHFFFAOYSA-N
XLogP0.03
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.05
LogP ≤ 50.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of argon;1,4-dioxane?
The IUPAC name of argon;1,4-dioxane (CID 87641547) is argon;1,4-dioxane.
What is the SMILES notation for argon;1,4-dioxane?
The canonical SMILES for argon;1,4-dioxane is C1COCCO1.[Ar].
What is the InChIKey of argon;1,4-dioxane?
The InChIKey is KQKIWKBZIQGNEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8O2.Ar/c1-2-6-4-3-5-1;/h1-4H2;.
What are the key properties of argon;1,4-dioxane?
argon;1,4-dioxane has a molecular weight of 128.05 g/mol, XLogP of 0.03, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for argon;1,4-dioxane is sourced from PubChem (CID 87641547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).