1-ethenoxy-2-(3-propoxypropoxy)propane

C11H22O3 — CID 154211630

IUPAC1-ethenoxy-2-(3-propoxypropoxy)propane
SMILESC=COCC(C)OCCCOCCC
InChIInChI=1S/C11H22O3/c1-4-7-13-8-6-9-14-11(3)10-12-5-2/h5,11H,2,4,6-10H2,1,3H3
InChIKeyUCWBEUUWOMBETI-UHFFFAOYSA-N
MW202.29 g/mol
LogP2.37
Rot. Bonds10

About 1-ethenoxy-2-(3-propoxypropoxy)propane

1-ethenoxy-2-(3-propoxypropoxy)propane (PubChem CID 154211630) has the molecular formula C11H22O3 and a molecular weight of 202.29 g/mol. Its IUPAC name is 1-ethenoxy-2-(3-propoxypropoxy)propane.

Molecular Properties

Compound Name1-ethenoxy-2-(3-propoxypropoxy)propane
PubChem CID154211630
Molecular FormulaC11H22O3
Molecular Weight202.29 g/mol
Exact Mass202.16
IUPAC Name1-ethenoxy-2-(3-propoxypropoxy)propane
SMILESC=COCC(C)OCCCOCCC
InChIInChI=1S/C11H22O3/c1-4-7-13-8-6-9-14-11(3)10-12-5-2/h5,11H,2,4,6-10H2,1,3H3
InChIKeyUCWBEUUWOMBETI-UHFFFAOYSA-N
XLogP2.37
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.29
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

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Diethylene glycol ethyl vinyl ether
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1,2,3-Triethoxypropane
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17,18-Epoxy-3,6,9,12,15-pentaoxa-1-octadecene
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2-[(Z)-2-propan-2-yloxyethenoxy]propane
CID 102121609
1,2,3-Tris(ethenyloxy)propane
CID 13516599
1-{2-[2-(2-Vinyloxyethoxy)ethoxy]-ethoxy}-2,3-epoxypropane
CID 15527222
1,2-Bis(ethenyloxy)propane
CID 15570361
4-Methyl-3,6-dioxaoct-7-ene
CID 17934856
1-Ethenoxy-1-fluoro-2-propoxypropane
CID 88059157
1-Ethenoxy-3-fluoro-2-propoxypropane
CID 88059158

Frequently Asked Questions

What is the IUPAC name of 1-ethenoxy-2-(3-propoxypropoxy)propane?
The IUPAC name of 1-ethenoxy-2-(3-propoxypropoxy)propane (CID 154211630) is 1-ethenoxy-2-(3-propoxypropoxy)propane.
What is the SMILES notation for 1-ethenoxy-2-(3-propoxypropoxy)propane?
The canonical SMILES for 1-ethenoxy-2-(3-propoxypropoxy)propane is C=COCC(C)OCCCOCCC.
What is the InChIKey of 1-ethenoxy-2-(3-propoxypropoxy)propane?
The InChIKey is UCWBEUUWOMBETI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O3/c1-4-7-13-8-6-9-14-11(3)10-12-5-2/h5,11H,2,4,6-10H2,1,3H3.
What are the key properties of 1-ethenoxy-2-(3-propoxypropoxy)propane?
1-ethenoxy-2-(3-propoxypropoxy)propane has a molecular weight of 202.29 g/mol, XLogP of 2.37, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenoxy-2-(3-propoxypropoxy)propane is sourced from PubChem (CID 154211630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).