1-methoxy-3-[2-[2-[2-(3-methoxypropoxy)ethoxy]ethoxy]ethoxy]propane

C14H30O6 — CID 135025894

IUPAC1-methoxy-3-[2-[2-[2-(3-methoxypropoxy)ethoxy]ethoxy]ethoxy]propane
SMILESCOCCCOCCOCCOCCOCCCOC
InChIInChI=1S/C14H30O6/c1-15-5-3-7-17-9-11-19-13-14-20-12-10-18-8-4-6-16-2/h3-14H2,1-2H3
InChIKeyOFRZEWJYFGMFSP-UHFFFAOYSA-N
MW294.39 g/mol
LogP1.13
Rot. Bonds17

About 1-methoxy-3-[2-[2-[2-(3-methoxypropoxy)ethoxy]ethoxy]ethoxy]propane

1-methoxy-3-[2-[2-[2-(3-methoxypropoxy)ethoxy]ethoxy]ethoxy]propane (PubChem CID 135025894) has the molecular formula C14H30O6 and a molecular weight of 294.39 g/mol. Its IUPAC name is 1-methoxy-3-[2-[2-[2-(3-methoxypropoxy)ethoxy]ethoxy]ethoxy]propane.

Molecular Properties

Compound Name1-methoxy-3-[2-[2-[2-(3-methoxypropoxy)ethoxy]ethoxy]ethoxy]propane
PubChem CID135025894
Molecular FormulaC14H30O6
Molecular Weight294.39 g/mol
Exact Mass294.20
IUPAC Name1-methoxy-3-[2-[2-[2-(3-methoxypropoxy)ethoxy]ethoxy]ethoxy]propane
SMILESCOCCCOCCOCCOCCOCCCOC
InChIInChI=1S/C14H30O6/c1-15-5-3-7-17-9-11-19-13-14-20-12-10-18-8-4-6-16-2/h3-14H2,1-2H3
InChIKeyOFRZEWJYFGMFSP-UHFFFAOYSA-N
XLogP1.13
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds17
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.39
LogP ≤ 51.13
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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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-3-[2-[2-[2-(3-methoxypropoxy)ethoxy]ethoxy]ethoxy]propane?
The IUPAC name of 1-methoxy-3-[2-[2-[2-(3-methoxypropoxy)ethoxy]ethoxy]ethoxy]propane (CID 135025894) is 1-methoxy-3-[2-[2-[2-(3-methoxypropoxy)ethoxy]ethoxy]ethoxy]propane.
What is the SMILES notation for 1-methoxy-3-[2-[2-[2-(3-methoxypropoxy)ethoxy]ethoxy]ethoxy]propane?
The canonical SMILES for 1-methoxy-3-[2-[2-[2-(3-methoxypropoxy)ethoxy]ethoxy]ethoxy]propane is COCCCOCCOCCOCCOCCCOC.
What is the InChIKey of 1-methoxy-3-[2-[2-[2-(3-methoxypropoxy)ethoxy]ethoxy]ethoxy]propane?
The InChIKey is OFRZEWJYFGMFSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30O6/c1-15-5-3-7-17-9-11-19-13-14-20-12-10-18-8-4-6-16-2/h3-14H2,1-2H3.
What are the key properties of 1-methoxy-3-[2-[2-[2-(3-methoxypropoxy)ethoxy]ethoxy]ethoxy]propane?
1-methoxy-3-[2-[2-[2-(3-methoxypropoxy)ethoxy]ethoxy]ethoxy]propane has a molecular weight of 294.39 g/mol, XLogP of 1.13, 17 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-3-[2-[2-[2-(3-methoxypropoxy)ethoxy]ethoxy]ethoxy]propane is sourced from PubChem (CID 135025894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).