1-prop-2-enoxy-2-[2-[2-(2-prop-2-enoxypropoxy)propoxy]propoxy]propane

C18H34O5 — CID 22421290

IUPAC1-prop-2-enoxy-2-[2-[2-(2-prop-2-enoxypropoxy)propoxy]propoxy]propane
SMILESC=CCOCC(C)OCC(C)OCC(C)OCC(C)OCC=C
InChIInChI=1S/C18H34O5/c1-7-9-19-11-15(3)21-13-17(5)23-14-18(6)22-12-16(4)20-10-8-2/h7-8,15-18H,1-2,9-14H2,3-6H3
InChIKeyUKNTWVPJRDTHEG-UHFFFAOYSA-N
MW330.47 g/mol
LogP3.00
Rot. Bonds16

About 1-prop-2-enoxy-2-[2-[2-(2-prop-2-enoxypropoxy)propoxy]propoxy]propane

1-prop-2-enoxy-2-[2-[2-(2-prop-2-enoxypropoxy)propoxy]propoxy]propane (PubChem CID 22421290) has the molecular formula C18H34O5 and a molecular weight of 330.47 g/mol. Its IUPAC name is 1-prop-2-enoxy-2-[2-[2-(2-prop-2-enoxypropoxy)propoxy]propoxy]propane.

Molecular Properties

Compound Name1-prop-2-enoxy-2-[2-[2-(2-prop-2-enoxypropoxy)propoxy]propoxy]propane
PubChem CID22421290
Molecular FormulaC18H34O5
Molecular Weight330.47 g/mol
Exact Mass330.24
IUPAC Name1-prop-2-enoxy-2-[2-[2-(2-prop-2-enoxypropoxy)propoxy]propoxy]propane
SMILESC=CCOCC(C)OCC(C)OCC(C)OCC(C)OCC=C
InChIInChI=1S/C18H34O5/c1-7-9-19-11-15(3)21-13-17(5)23-14-18(6)22-12-16(4)20-10-8-2/h7-8,15-18H,1-2,9-14H2,3-6H3
InChIKeyUKNTWVPJRDTHEG-UHFFFAOYSA-N
XLogP3.00
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds16
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.47
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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 1-prop-2-enoxy-2-[2-[2-(2-prop-2-enoxypropoxy)propoxy]propoxy]propane?
The IUPAC name of 1-prop-2-enoxy-2-[2-[2-(2-prop-2-enoxypropoxy)propoxy]propoxy]propane (CID 22421290) is 1-prop-2-enoxy-2-[2-[2-(2-prop-2-enoxypropoxy)propoxy]propoxy]propane.
What is the SMILES notation for 1-prop-2-enoxy-2-[2-[2-(2-prop-2-enoxypropoxy)propoxy]propoxy]propane?
The canonical SMILES for 1-prop-2-enoxy-2-[2-[2-(2-prop-2-enoxypropoxy)propoxy]propoxy]propane is C=CCOCC(C)OCC(C)OCC(C)OCC(C)OCC=C.
What is the InChIKey of 1-prop-2-enoxy-2-[2-[2-(2-prop-2-enoxypropoxy)propoxy]propoxy]propane?
The InChIKey is UKNTWVPJRDTHEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34O5/c1-7-9-19-11-15(3)21-13-17(5)23-14-18(6)22-12-16(4)20-10-8-2/h7-8,15-18H,1-2,9-14H2,3-6H3.
What are the key properties of 1-prop-2-enoxy-2-[2-[2-(2-prop-2-enoxypropoxy)propoxy]propoxy]propane?
1-prop-2-enoxy-2-[2-[2-(2-prop-2-enoxypropoxy)propoxy]propoxy]propane has a molecular weight of 330.47 g/mol, XLogP of 3.00, 16 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-prop-2-enoxy-2-[2-[2-(2-prop-2-enoxypropoxy)propoxy]propoxy]propane is sourced from PubChem (CID 22421290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).