7,7,16,16-tetramethyl-1,4,10,13-tetraoxacyclooctadecane

C18H36O4 — CID 59046060

IUPAC7,7,16,16-tetramethyl-1,4,10,13-tetraoxacyclooctadecane
SMILESCC1(C)CCOCCOCCC(C)(C)CCOCCOCC1
InChIInChI=1S/C18H36O4/c1-17(2)5-9-19-13-15-21-11-7-18(3,4)8-12-22-16-14-20-10-6-17/h5-16H2,1-4H3
InChIKeySKTOGKNPYUSWLL-UHFFFAOYSA-N
MW316.48 g/mol
LogP3.68
Rot. Bonds

About 7,7,16,16-tetramethyl-1,4,10,13-tetraoxacyclooctadecane

7,7,16,16-tetramethyl-1,4,10,13-tetraoxacyclooctadecane (PubChem CID 59046060) has the molecular formula C18H36O4 and a molecular weight of 316.48 g/mol. Its IUPAC name is 7,7,16,16-tetramethyl-1,4,10,13-tetraoxacyclooctadecane.

Molecular Properties

Compound Name7,7,16,16-tetramethyl-1,4,10,13-tetraoxacyclooctadecane
PubChem CID59046060
Molecular FormulaC18H36O4
Molecular Weight316.48 g/mol
Exact Mass316.26
IUPAC Name7,7,16,16-tetramethyl-1,4,10,13-tetraoxacyclooctadecane
SMILESCC1(C)CCOCCOCCC(C)(C)CCOCCOCC1
InChIInChI=1S/C18H36O4/c1-17(2)5-9-19-13-15-21-11-7-18(3,4)8-12-22-16-14-20-10-6-17/h5-16H2,1-4H3
InChIKeySKTOGKNPYUSWLL-UHFFFAOYSA-N
XLogP3.68
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.48
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3,3'-Isopropylidenebis(1,5,8,11-tetraoxacyclotridecane)
CID 560723
5-[2-(5-Hydroxy-3,3-dimethylpentoxy)ethoxy]-3,3-dimethylpentan-1-ol
CID 11380742
4,7,13,16,21,24-Hexaoxabicyclo[8.8.8]hexacosane
CID 15241470
1-[2-(2-Ethoxyethoxy)ethoxy]-3-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxymethyl]-5-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pentane
CID 19877939
1-[2-[2-(2-Ethoxyethoxy)ethoxy]ethoxy]-3-[2-(2-ethoxyethoxy)ethoxymethyl]-5-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pentane
CID 19978673
[2-(Dimethylphosphanylmethyl)-4-(2-propoxyethoxy)-2-[2-(2-propoxyethoxy)ethyl]butyl]-dimethylphosphane
CID 20712733
[2-(Dimethylphosphanylmethyl)-4-[2-(2-ethoxyethoxy)ethoxy]-2-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]butyl]-dimethylphosphane
CID 23560463
4,7,13,16,21-Pentaoxabicyclo[8.8.5]tricosane
CID 58704531
1,5-Dimethoxy-3,3-bis(2-methoxyethyl)pentane
CID 58757994
1,5-Dimethoxy-3-[[4-methoxy-2,2-bis(2-methoxyethyl)butoxy]methyl]-3-(2-methoxyethyl)pentane
CID 58757996
4,4,10,10-Tetramethyl-1,7-dioxacyclododecane
CID 59046020
1,5-Bis(2-methoxyethoxy)-3-(2-methoxyethoxymethyl)pentane
CID 59118349

Frequently Asked Questions

What is the IUPAC name of 7,7,16,16-tetramethyl-1,4,10,13-tetraoxacyclooctadecane?
The IUPAC name of 7,7,16,16-tetramethyl-1,4,10,13-tetraoxacyclooctadecane (CID 59046060) is 7,7,16,16-tetramethyl-1,4,10,13-tetraoxacyclooctadecane.
What is the SMILES notation for 7,7,16,16-tetramethyl-1,4,10,13-tetraoxacyclooctadecane?
The canonical SMILES for 7,7,16,16-tetramethyl-1,4,10,13-tetraoxacyclooctadecane is CC1(C)CCOCCOCCC(C)(C)CCOCCOCC1.
What is the InChIKey of 7,7,16,16-tetramethyl-1,4,10,13-tetraoxacyclooctadecane?
The InChIKey is SKTOGKNPYUSWLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36O4/c1-17(2)5-9-19-13-15-21-11-7-18(3,4)8-12-22-16-14-20-10-6-17/h5-16H2,1-4H3.
What are the key properties of 7,7,16,16-tetramethyl-1,4,10,13-tetraoxacyclooctadecane?
7,7,16,16-tetramethyl-1,4,10,13-tetraoxacyclooctadecane has a molecular weight of 316.48 g/mol, XLogP of 3.68, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7,16,16-tetramethyl-1,4,10,13-tetraoxacyclooctadecane is sourced from PubChem (CID 59046060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).