3-methoxy-2,4,5-trimethyl-6-(2,4,5,6-tetramethyloxan-3-yl)oxyoxane

C18H34O4 — CID 20745636

IUPAC3-methoxy-2,4,5-trimethyl-6-(2,4,5,6-tetramethyloxan-3-yl)oxyoxane
SMILESCOC1C(C)OC(OC2C(C)OC(C)C(C)C2C)C(C)C1C
InChIInChI=1S/C18H34O4/c1-9-10(2)17(15(7)20-13(9)5)22-18-12(4)11(3)16(19-8)14(6)21-18/h9-18H,1-8H3
InChIKeyQTEHDIQGAWPSKL-UHFFFAOYSA-N
MW314.47 g/mol
LogP3.48
Rot. Bonds3

About 3-methoxy-2,4,5-trimethyl-6-(2,4,5,6-tetramethyloxan-3-yl)oxyoxane

3-methoxy-2,4,5-trimethyl-6-(2,4,5,6-tetramethyloxan-3-yl)oxyoxane (PubChem CID 20745636) has the molecular formula C18H34O4 and a molecular weight of 314.47 g/mol. Its IUPAC name is 3-methoxy-2,4,5-trimethyl-6-(2,4,5,6-tetramethyloxan-3-yl)oxyoxane.

Molecular Properties

Compound Name3-methoxy-2,4,5-trimethyl-6-(2,4,5,6-tetramethyloxan-3-yl)oxyoxane
PubChem CID20745636
Molecular FormulaC18H34O4
Molecular Weight314.47 g/mol
Exact Mass314.25
IUPAC Name3-methoxy-2,4,5-trimethyl-6-(2,4,5,6-tetramethyloxan-3-yl)oxyoxane
SMILESCOC1C(C)OC(OC2C(C)OC(C)C(C)C2C)C(C)C1C
InChIInChI=1S/C18H34O4/c1-9-10(2)17(15(7)20-13(9)5)22-18-12(4)11(3)16(19-8)14(6)21-18/h9-18H,1-8H3
InChIKeyQTEHDIQGAWPSKL-UHFFFAOYSA-N
XLogP3.48
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.47
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2,4,5-trimethyl-6-(2,4,5,6-tetramethyloxan-3-yl)oxyoxane?
The IUPAC name of 3-methoxy-2,4,5-trimethyl-6-(2,4,5,6-tetramethyloxan-3-yl)oxyoxane (CID 20745636) is 3-methoxy-2,4,5-trimethyl-6-(2,4,5,6-tetramethyloxan-3-yl)oxyoxane.
What is the SMILES notation for 3-methoxy-2,4,5-trimethyl-6-(2,4,5,6-tetramethyloxan-3-yl)oxyoxane?
The canonical SMILES for 3-methoxy-2,4,5-trimethyl-6-(2,4,5,6-tetramethyloxan-3-yl)oxyoxane is COC1C(C)OC(OC2C(C)OC(C)C(C)C2C)C(C)C1C.
What is the InChIKey of 3-methoxy-2,4,5-trimethyl-6-(2,4,5,6-tetramethyloxan-3-yl)oxyoxane?
The InChIKey is QTEHDIQGAWPSKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34O4/c1-9-10(2)17(15(7)20-13(9)5)22-18-12(4)11(3)16(19-8)14(6)21-18/h9-18H,1-8H3.
What are the key properties of 3-methoxy-2,4,5-trimethyl-6-(2,4,5,6-tetramethyloxan-3-yl)oxyoxane?
3-methoxy-2,4,5-trimethyl-6-(2,4,5,6-tetramethyloxan-3-yl)oxyoxane has a molecular weight of 314.47 g/mol, XLogP of 3.48, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2,4,5-trimethyl-6-(2,4,5,6-tetramethyloxan-3-yl)oxyoxane is sourced from PubChem (CID 20745636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).