5-methoxy-2,2-dimethyloxolane

C7H14O2 — CID 19753537

IUPAC5-methoxy-2,2-dimethyloxolane
SMILESCOC1CCC(C)(C)O1
InChIInChI=1S/C7H14O2/c1-7(2)5-4-6(8-3)9-7/h6H,4-5H2,1-3H3
InChIKeyWWALRPLQVQFAER-UHFFFAOYSA-N
MW130.19 g/mol
LogP1.55
Rot. Bonds1

About 5-methoxy-2,2-dimethyloxolane

5-methoxy-2,2-dimethyloxolane (PubChem CID 19753537) has the molecular formula C7H14O2 and a molecular weight of 130.19 g/mol. Its IUPAC name is 5-methoxy-2,2-dimethyloxolane.

Molecular Properties

Compound Name5-methoxy-2,2-dimethyloxolane
PubChem CID19753537
Molecular FormulaC7H14O2
Molecular Weight130.19 g/mol
Exact Mass130.10
IUPAC Name5-methoxy-2,2-dimethyloxolane
SMILESCOC1CCC(C)(C)O1
InChIInChI=1S/C7H14O2/c1-7(2)5-4-6(8-3)9-7/h6H,4-5H2,1-3H3
InChIKeyWWALRPLQVQFAER-UHFFFAOYSA-N
XLogP1.55
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 ≤ 51.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2,2-dimethyloxolane?
The IUPAC name of 5-methoxy-2,2-dimethyloxolane (CID 19753537) is 5-methoxy-2,2-dimethyloxolane.
What is the SMILES notation for 5-methoxy-2,2-dimethyloxolane?
The canonical SMILES for 5-methoxy-2,2-dimethyloxolane is COC1CCC(C)(C)O1.
What is the InChIKey of 5-methoxy-2,2-dimethyloxolane?
The InChIKey is WWALRPLQVQFAER-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O2/c1-7(2)5-4-6(8-3)9-7/h6H,4-5H2,1-3H3.
What are the key properties of 5-methoxy-2,2-dimethyloxolane?
5-methoxy-2,2-dimethyloxolane has a molecular weight of 130.19 g/mol, XLogP of 1.55, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2,2-dimethyloxolane is sourced from PubChem (CID 19753537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).