1,5-bis(2-methoxyethoxy)-3-(2-methoxyethoxymethyl)pentane

C15H32O6 — CID 59118349

IUPAC1,5-bis(2-methoxyethoxy)-3-(2-methoxyethoxymethyl)pentane
SMILESCOCCOCCC(CCOCCOC)COCCOC
InChIInChI=1S/C15H32O6/c1-16-8-11-19-6-4-15(14-21-13-10-18-3)5-7-20-12-9-17-2/h15H,4-14H2,1-3H3
InChIKeyYOOAPLZQNGVDJZ-UHFFFAOYSA-N
MW308.41 g/mol
LogP1.37
Rot. Bonds17

About 1,5-bis(2-methoxyethoxy)-3-(2-methoxyethoxymethyl)pentane

1,5-bis(2-methoxyethoxy)-3-(2-methoxyethoxymethyl)pentane (PubChem CID 59118349) has the molecular formula C15H32O6 and a molecular weight of 308.41 g/mol. Its IUPAC name is 1,5-bis(2-methoxyethoxy)-3-(2-methoxyethoxymethyl)pentane.

Molecular Properties

Compound Name1,5-bis(2-methoxyethoxy)-3-(2-methoxyethoxymethyl)pentane
PubChem CID59118349
Molecular FormulaC15H32O6
Molecular Weight308.41 g/mol
Exact Mass308.22
IUPAC Name1,5-bis(2-methoxyethoxy)-3-(2-methoxyethoxymethyl)pentane
SMILESCOCCOCCC(CCOCCOC)COCCOC
InChIInChI=1S/C15H32O6/c1-16-8-11-19-6-4-15(14-21-13-10-18-3)5-7-20-12-9-17-2/h15H,4-14H2,1-3H3
InChIKeyYOOAPLZQNGVDJZ-UHFFFAOYSA-N
XLogP1.37
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds17
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.41
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

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
1-(2-Ethoxyethoxy)-5-(4-propoxybutoxy)pentane
CID 54336759
1,5-Dipropoxy-3-(2-propoxyethyl)pentane
CID 58572257
4,7,13,16,21-Pentaoxabicyclo[8.8.5]tricosane
CID 58704531
7,7,16,16-Tetramethyl-1,4,10,13-tetraoxacyclooctadecane
CID 59046060
13-Propan-2-yl-1,4,7,10-tetraoxacyclopentadecane
CID 59686750
4,7,13,18-Tetraoxabicyclo[8.5.5]icosane
CID 59876118
3-Methyl-5,8,11,14,17-pentaoxadocosane
CID 88326525
13-Methyl-1,4,7,10-tetraoxacyclopentadecane
CID 89291115
1,3-Bis(2-methoxyethoxy)propane;1,5-dimethoxy-3-(methoxymethyl)pentane
CID 90787039

Frequently Asked Questions

What is the IUPAC name of 1,5-bis(2-methoxyethoxy)-3-(2-methoxyethoxymethyl)pentane?
The IUPAC name of 1,5-bis(2-methoxyethoxy)-3-(2-methoxyethoxymethyl)pentane (CID 59118349) is 1,5-bis(2-methoxyethoxy)-3-(2-methoxyethoxymethyl)pentane.
What is the SMILES notation for 1,5-bis(2-methoxyethoxy)-3-(2-methoxyethoxymethyl)pentane?
The canonical SMILES for 1,5-bis(2-methoxyethoxy)-3-(2-methoxyethoxymethyl)pentane is COCCOCCC(CCOCCOC)COCCOC.
What is the InChIKey of 1,5-bis(2-methoxyethoxy)-3-(2-methoxyethoxymethyl)pentane?
The InChIKey is YOOAPLZQNGVDJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O6/c1-16-8-11-19-6-4-15(14-21-13-10-18-3)5-7-20-12-9-17-2/h15H,4-14H2,1-3H3.
What are the key properties of 1,5-bis(2-methoxyethoxy)-3-(2-methoxyethoxymethyl)pentane?
1,5-bis(2-methoxyethoxy)-3-(2-methoxyethoxymethyl)pentane has a molecular weight of 308.41 g/mol, XLogP of 1.37, 17 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-bis(2-methoxyethoxy)-3-(2-methoxyethoxymethyl)pentane is sourced from PubChem (CID 59118349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).