1-ethoxypropyl hypoiodite

C5H11IO2 — CID 88918187

IUPAC1-ethoxypropyl hypoiodite
SMILESCCOC(CC)OI
InChIInChI=1S/C5H11IO2/c1-3-5(8-6)7-4-2/h5H,3-4H2,1-2H3
InChIKeyCPCQLCSUWRTLNT-UHFFFAOYSA-N
MW230.04 g/mol
LogP2.13
Rot. Bonds4

About 1-ethoxypropyl hypoiodite

1-ethoxypropyl hypoiodite (PubChem CID 88918187) has the molecular formula C5H11IO2 and a molecular weight of 230.04 g/mol. Its IUPAC name is 1-ethoxypropyl hypoiodite.

Molecular Properties

Compound Name1-ethoxypropyl hypoiodite
PubChem CID88918187
Molecular FormulaC5H11IO2
Molecular Weight230.04 g/mol
Exact Mass229.98
IUPAC Name1-ethoxypropyl hypoiodite
SMILESCCOC(CC)OI
InChIInChI=1S/C5H11IO2/c1-3-5(8-6)7-4-2/h5H,3-4H2,1-2H3
InChIKeyCPCQLCSUWRTLNT-UHFFFAOYSA-N
XLogP2.13
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.04
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-ethoxypropyl hypoiodite?
The IUPAC name of 1-ethoxypropyl hypoiodite (CID 88918187) is 1-ethoxypropyl hypoiodite.
What is the SMILES notation for 1-ethoxypropyl hypoiodite?
The canonical SMILES for 1-ethoxypropyl hypoiodite is CCOC(CC)OI.
What is the InChIKey of 1-ethoxypropyl hypoiodite?
The InChIKey is CPCQLCSUWRTLNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11IO2/c1-3-5(8-6)7-4-2/h5H,3-4H2,1-2H3.
What are the key properties of 1-ethoxypropyl hypoiodite?
1-ethoxypropyl hypoiodite has a molecular weight of 230.04 g/mol, XLogP of 2.13, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxypropyl hypoiodite is sourced from PubChem (CID 88918187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).