4-methoxy-2-methyl-6-[(2-methylpropan-2-yl)oxy]oxan-3-ol

C11H22O4 — CID 166761639

IUPAC4-methoxy-2-methyl-6-[(2-methylpropan-2-yl)oxy]oxan-3-ol
SMILESCOC1CC(OC(C)(C)C)OC(C)C1O
InChIInChI=1S/C11H22O4/c1-7-10(12)8(13-5)6-9(14-7)15-11(2,3)4/h7-10,12H,6H2,1-5H3
InChIKeyUHQVVNAKAVANID-UHFFFAOYSA-N
MW218.29 g/mol
LogP1.31
Rot. Bonds2

About 4-methoxy-2-methyl-6-[(2-methylpropan-2-yl)oxy]oxan-3-ol

4-methoxy-2-methyl-6-[(2-methylpropan-2-yl)oxy]oxan-3-ol (PubChem CID 166761639) has the molecular formula C11H22O4 and a molecular weight of 218.29 g/mol. Its IUPAC name is 4-methoxy-2-methyl-6-[(2-methylpropan-2-yl)oxy]oxan-3-ol.

Molecular Properties

Compound Name4-methoxy-2-methyl-6-[(2-methylpropan-2-yl)oxy]oxan-3-ol
PubChem CID166761639
Molecular FormulaC11H22O4
Molecular Weight218.29 g/mol
Exact Mass218.15
IUPAC Name4-methoxy-2-methyl-6-[(2-methylpropan-2-yl)oxy]oxan-3-ol
SMILESCOC1CC(OC(C)(C)C)OC(C)C1O
InChIInChI=1S/C11H22O4/c1-7-10(12)8(13-5)6-9(14-7)15-11(2,3)4/h7-10,12H,6H2,1-5H3
InChIKeyUHQVVNAKAVANID-UHFFFAOYSA-N
XLogP1.31
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.29
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-methyl-6-[(2-methylpropan-2-yl)oxy]oxan-3-ol?
The IUPAC name of 4-methoxy-2-methyl-6-[(2-methylpropan-2-yl)oxy]oxan-3-ol (CID 166761639) is 4-methoxy-2-methyl-6-[(2-methylpropan-2-yl)oxy]oxan-3-ol.
What is the SMILES notation for 4-methoxy-2-methyl-6-[(2-methylpropan-2-yl)oxy]oxan-3-ol?
The canonical SMILES for 4-methoxy-2-methyl-6-[(2-methylpropan-2-yl)oxy]oxan-3-ol is COC1CC(OC(C)(C)C)OC(C)C1O.
What is the InChIKey of 4-methoxy-2-methyl-6-[(2-methylpropan-2-yl)oxy]oxan-3-ol?
The InChIKey is UHQVVNAKAVANID-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O4/c1-7-10(12)8(13-5)6-9(14-7)15-11(2,3)4/h7-10,12H,6H2,1-5H3.
What are the key properties of 4-methoxy-2-methyl-6-[(2-methylpropan-2-yl)oxy]oxan-3-ol?
4-methoxy-2-methyl-6-[(2-methylpropan-2-yl)oxy]oxan-3-ol has a molecular weight of 218.29 g/mol, XLogP of 1.31, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-methyl-6-[(2-methylpropan-2-yl)oxy]oxan-3-ol is sourced from PubChem (CID 166761639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).