1,4,7,10,13,16-hexaoxacyclooctadecane

C12H24O6 — CID 28557

IUPAC1,4,7,10,13,16-hexaoxacyclooctadecane
SMILESC1COCCOCCOCCOCCOCCO1
InChIInChI=1S/C12H24O6/c1-2-14-5-6-16-9-10-18-12-11-17-8-7-15-4-3-13-1/h1-12H2
InChIKeyXEZNGIUYQVAUSS-UHFFFAOYSA-N
MW264.32 g/mol
LogP0.10
Rot. Bonds

About 1,4,7,10,13,16-hexaoxacyclooctadecane

1,4,7,10,13,16-hexaoxacyclooctadecane (PubChem CID 28557) has the molecular formula C12H24O6 and a molecular weight of 264.32 g/mol. Its IUPAC name is 1,4,7,10,13,16-hexaoxacyclooctadecane.

Molecular Properties

Compound Name1,4,7,10,13,16-hexaoxacyclooctadecane
PubChem CID28557
Molecular FormulaC12H24O6
Molecular Weight264.32 g/mol
Exact Mass264.16
IUPAC Name1,4,7,10,13,16-hexaoxacyclooctadecane
SMILESC1COCCOCCOCCOCCOCCO1
InChIInChI=1S/C12H24O6/c1-2-14-5-6-16-9-10-18-12-11-17-8-7-15-4-3-13-1/h1-12H2
InChIKeyXEZNGIUYQVAUSS-UHFFFAOYSA-N
XLogP0.10
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 50.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 1,4,7,10,13,16-hexaoxacyclooctadecane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Tetraglyme
CID 8925
Diethylene glycol diethyl ether
CID 8179
15-Crown-5
CID 36336
Triglyme
CID 8189
1,4,7,10-Tetraoxacyclododecane
CID 9269
3,6,9,12,15-Pentaoxaheptadecane
CID 78057
3,6,9,12,15,18-Hexaoxaeicosane
CID 90206
5,8,11,14-Tetraoxaoctadecane
CID 2733908
1-Ethoxy-2-(2-methoxyethoxy)ethane
CID 13847
2,5,8,11,14,17-Hexaoxaoctadecane
CID 70931
Yttrium trimethoxyethoxide
CID 14452922
2,5,8,11,14,17,20-Heptaoxaheneicosane
CID 70621

Frequently Asked Questions

What is the IUPAC name of 1,4,7,10,13,16-hexaoxacyclooctadecane?
The IUPAC name of 1,4,7,10,13,16-hexaoxacyclooctadecane (CID 28557) is 1,4,7,10,13,16-hexaoxacyclooctadecane.
What is the SMILES notation for 1,4,7,10,13,16-hexaoxacyclooctadecane?
The canonical SMILES for 1,4,7,10,13,16-hexaoxacyclooctadecane is C1COCCOCCOCCOCCOCCO1.
What is the InChIKey of 1,4,7,10,13,16-hexaoxacyclooctadecane?
The InChIKey is XEZNGIUYQVAUSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O6/c1-2-14-5-6-16-9-10-18-12-11-17-8-7-15-4-3-13-1/h1-12H2.
What are the key properties of 1,4,7,10,13,16-hexaoxacyclooctadecane?
1,4,7,10,13,16-hexaoxacyclooctadecane has a molecular weight of 264.32 g/mol, XLogP of 0.10, 0 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4,7,10,13,16-hexaoxacyclooctadecane is sourced from PubChem (CID 28557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).