2-[2-[2-[2-(2-but-3-en-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]ethanol

C14H28O6 — CID 54151457

IUPAC2-[2-[2-[2-(2-but-3-en-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]ethanol
SMILESC=CC(C)OCCOCCOCCOCCOCCO
InChIInChI=1S/C14H28O6/c1-3-14(2)20-13-12-19-11-10-18-9-8-17-7-6-16-5-4-15/h3,14-15H,1,4-13H2,2H3
InChIKeyOIAKMJMPNVRCHI-UHFFFAOYSA-N
MW292.37 g/mol
LogP0.64
Rot. Bonds16

About 2-[2-[2-[2-(2-but-3-en-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]ethanol

2-[2-[2-[2-(2-but-3-en-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]ethanol (PubChem CID 54151457) has the molecular formula C14H28O6 and a molecular weight of 292.37 g/mol. Its IUPAC name is 2-[2-[2-[2-(2-but-3-en-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-[2-[2-(2-but-3-en-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]ethanol
PubChem CID54151457
Molecular FormulaC14H28O6
Molecular Weight292.37 g/mol
Exact Mass292.19
IUPAC Name2-[2-[2-[2-(2-but-3-en-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]ethanol
SMILESC=CC(C)OCCOCCOCCOCCOCCO
InChIInChI=1S/C14H28O6/c1-3-14(2)20-13-12-19-11-10-18-9-8-17-7-6-16-5-4-15/h3,14-15H,1,4-13H2,2H3
InChIKeyOIAKMJMPNVRCHI-UHFFFAOYSA-N
XLogP0.64
TPSA66.38 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds16
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.37
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[2-(2-but-3-en-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]ethanol?
The IUPAC name of 2-[2-[2-[2-(2-but-3-en-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]ethanol (CID 54151457) is 2-[2-[2-[2-(2-but-3-en-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]ethanol.
What is the SMILES notation for 2-[2-[2-[2-(2-but-3-en-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]ethanol?
The canonical SMILES for 2-[2-[2-[2-(2-but-3-en-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]ethanol is C=CC(C)OCCOCCOCCOCCOCCO.
What is the InChIKey of 2-[2-[2-[2-(2-but-3-en-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]ethanol?
The InChIKey is OIAKMJMPNVRCHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O6/c1-3-14(2)20-13-12-19-11-10-18-9-8-17-7-6-16-5-4-15/h3,14-15H,1,4-13H2,2H3.
What are the key properties of 2-[2-[2-[2-(2-but-3-en-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]ethanol?
2-[2-[2-[2-(2-but-3-en-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]ethanol has a molecular weight of 292.37 g/mol, XLogP of 0.64, 16 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[2-(2-but-3-en-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]ethanol is sourced from PubChem (CID 54151457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).