4-methoxy-2,2-dimethyloxolane

C7H14O2 — CID 142607687

IUPAC4-methoxy-2,2-dimethyloxolane
SMILESCOC1COC(C)(C)C1
InChIInChI=1S/C7H14O2/c1-7(2)4-6(8-3)5-9-7/h6H,4-5H2,1-3H3
InChIKeyUPBIZPDHIDGZOR-UHFFFAOYSA-N
MW130.19 g/mol
LogP1.20
Rot. Bonds1

About 4-methoxy-2,2-dimethyloxolane

4-methoxy-2,2-dimethyloxolane (PubChem CID 142607687) has the molecular formula C7H14O2 and a molecular weight of 130.19 g/mol. Its IUPAC name is 4-methoxy-2,2-dimethyloxolane.

Molecular Properties

Compound Name4-methoxy-2,2-dimethyloxolane
PubChem CID142607687
Molecular FormulaC7H14O2
Molecular Weight130.19 g/mol
Exact Mass130.10
IUPAC Name4-methoxy-2,2-dimethyloxolane
SMILESCOC1COC(C)(C)C1
InChIInChI=1S/C7H14O2/c1-7(2)4-6(8-3)5-9-7/h6H,4-5H2,1-3H3
InChIKeyUPBIZPDHIDGZOR-UHFFFAOYSA-N
XLogP1.20
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 51.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2,2-dimethyloxolane?
The IUPAC name of 4-methoxy-2,2-dimethyloxolane (CID 142607687) is 4-methoxy-2,2-dimethyloxolane.
What is the SMILES notation for 4-methoxy-2,2-dimethyloxolane?
The canonical SMILES for 4-methoxy-2,2-dimethyloxolane is COC1COC(C)(C)C1.
What is the InChIKey of 4-methoxy-2,2-dimethyloxolane?
The InChIKey is UPBIZPDHIDGZOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O2/c1-7(2)4-6(8-3)5-9-7/h6H,4-5H2,1-3H3.
What are the key properties of 4-methoxy-2,2-dimethyloxolane?
4-methoxy-2,2-dimethyloxolane has a molecular weight of 130.19 g/mol, XLogP of 1.20, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2,2-dimethyloxolane is sourced from PubChem (CID 142607687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).