1,4,7,10,13,16,19,22-octaoxacyclopentacosane

C17H34O8 — CID 56616647

IUPAC1,4,7,10,13,16,19,22-octaoxacyclopentacosane
SMILESC1COCCOCCOCCOCCOCCOCCOCCOC1
InChIInChI=1S/C17H34O8/c1-2-18-4-6-20-8-10-22-12-14-24-16-17-25-15-13-23-11-9-21-7-5-19-3-1/h1-17H2
InChIKeyDYFNTKWWBZXGKD-UHFFFAOYSA-N
MW366.45 g/mol
LogP0.52
Rot. Bonds

About 1,4,7,10,13,16,19,22-octaoxacyclopentacosane

1,4,7,10,13,16,19,22-octaoxacyclopentacosane (PubChem CID 56616647) has the molecular formula C17H34O8 and a molecular weight of 366.45 g/mol. Its IUPAC name is 1,4,7,10,13,16,19,22-octaoxacyclopentacosane.

Molecular Properties

Compound Name1,4,7,10,13,16,19,22-octaoxacyclopentacosane
PubChem CID56616647
Molecular FormulaC17H34O8
Molecular Weight366.45 g/mol
Exact Mass366.23
IUPAC Name1,4,7,10,13,16,19,22-octaoxacyclopentacosane
SMILESC1COCCOCCOCCOCCOCCOCCOCCOC1
InChIInChI=1S/C17H34O8/c1-2-18-4-6-20-8-10-22-12-14-24-16-17-25-15-13-23-11-9-21-7-5-19-3-1/h1-17H2
InChIKeyDYFNTKWWBZXGKD-UHFFFAOYSA-N
XLogP0.52
TPSA73.84 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.45
LogP ≤ 50.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 1,4,7,10,13,16,19,22-octaoxacyclopentacosane?
The IUPAC name of 1,4,7,10,13,16,19,22-octaoxacyclopentacosane (CID 56616647) is 1,4,7,10,13,16,19,22-octaoxacyclopentacosane.
What is the SMILES notation for 1,4,7,10,13,16,19,22-octaoxacyclopentacosane?
The canonical SMILES for 1,4,7,10,13,16,19,22-octaoxacyclopentacosane is C1COCCOCCOCCOCCOCCOCCOCCOC1.
What is the InChIKey of 1,4,7,10,13,16,19,22-octaoxacyclopentacosane?
The InChIKey is DYFNTKWWBZXGKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34O8/c1-2-18-4-6-20-8-10-22-12-14-24-16-17-25-15-13-23-11-9-21-7-5-19-3-1/h1-17H2.
What are the key properties of 1,4,7,10,13,16,19,22-octaoxacyclopentacosane?
1,4,7,10,13,16,19,22-octaoxacyclopentacosane has a molecular weight of 366.45 g/mol, XLogP of 0.52, 0 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4,7,10,13,16,19,22-octaoxacyclopentacosane is sourced from PubChem (CID 56616647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).