2-ethenoxy-1-(2-ethenoxypropoxy)propane

C10H18O3 — CID 23539979

IUPAC2-ethenoxy-1-(2-ethenoxypropoxy)propane
SMILESC=COC(C)COCC(C)OC=C
InChIInChI=1S/C10H18O3/c1-5-12-9(3)7-11-8-10(4)13-6-2/h5-6,9-10H,1-2,7-8H2,3-4H3
InChIKeyQHJPFPYHHRCOGQ-UHFFFAOYSA-N
MW186.25 g/mol
LogP2.10
Rot. Bonds8

About 2-ethenoxy-1-(2-ethenoxypropoxy)propane

2-ethenoxy-1-(2-ethenoxypropoxy)propane (PubChem CID 23539979) has the molecular formula C10H18O3 and a molecular weight of 186.25 g/mol. Its IUPAC name is 2-ethenoxy-1-(2-ethenoxypropoxy)propane.

Molecular Properties

Compound Name2-ethenoxy-1-(2-ethenoxypropoxy)propane
PubChem CID23539979
Molecular FormulaC10H18O3
Molecular Weight186.25 g/mol
Exact Mass186.13
IUPAC Name2-ethenoxy-1-(2-ethenoxypropoxy)propane
SMILESC=COC(C)COCC(C)OC=C
InChIInChI=1S/C10H18O3/c1-5-12-9(3)7-11-8-10(4)13-6-2/h5-6,9-10H,1-2,7-8H2,3-4H3
InChIKeyQHJPFPYHHRCOGQ-UHFFFAOYSA-N
XLogP2.10
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-ethenoxy-1-(2-ethenoxypropoxy)propane?
The IUPAC name of 2-ethenoxy-1-(2-ethenoxypropoxy)propane (CID 23539979) is 2-ethenoxy-1-(2-ethenoxypropoxy)propane.
What is the SMILES notation for 2-ethenoxy-1-(2-ethenoxypropoxy)propane?
The canonical SMILES for 2-ethenoxy-1-(2-ethenoxypropoxy)propane is C=COC(C)COCC(C)OC=C.
What is the InChIKey of 2-ethenoxy-1-(2-ethenoxypropoxy)propane?
The InChIKey is QHJPFPYHHRCOGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O3/c1-5-12-9(3)7-11-8-10(4)13-6-2/h5-6,9-10H,1-2,7-8H2,3-4H3.
What are the key properties of 2-ethenoxy-1-(2-ethenoxypropoxy)propane?
2-ethenoxy-1-(2-ethenoxypropoxy)propane has a molecular weight of 186.25 g/mol, XLogP of 2.10, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenoxy-1-(2-ethenoxypropoxy)propane is sourced from PubChem (CID 23539979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).