(2R)-3-ethoxy-2-iodooxolane

C6H11IO2 — CID 146185883

IUPAC(2R)-3-ethoxy-2-iodooxolane
SMILESCCOC1CCO[C@@H]1I
InChIInChI=1S/C6H11IO2/c1-2-8-5-3-4-9-6(5)7/h5-6H,2-4H2,1H3/t5?,6-/m0/s1
InChIKeyUQLAASNMYOYFQN-GDVGLLTNSA-N
MW242.06 g/mol
LogP1.57
Rot. Bonds2

About (2R)-3-ethoxy-2-iodooxolane

(2R)-3-ethoxy-2-iodooxolane (PubChem CID 146185883) has the molecular formula C6H11IO2 and a molecular weight of 242.06 g/mol. Its IUPAC name is (2R)-3-ethoxy-2-iodooxolane.

Molecular Properties

Compound Name(2R)-3-ethoxy-2-iodooxolane
PubChem CID146185883
Molecular FormulaC6H11IO2
Molecular Weight242.06 g/mol
Exact Mass241.98
IUPAC Name(2R)-3-ethoxy-2-iodooxolane
SMILESCCOC1CCO[C@@H]1I
InChIInChI=1S/C6H11IO2/c1-2-8-5-3-4-9-6(5)7/h5-6H,2-4H2,1H3/t5?,6-/m0/s1
InChIKeyUQLAASNMYOYFQN-GDVGLLTNSA-N
XLogP1.57
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.06
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

(2R,3S)-2-iodo-3-methoxyoxolane
CID 162786702
trans-(1R,2R)-1-ethoxy-2-iodocyclopentane
CID 138481777
trans-(1R,2R)-1,2-diethoxycyclohexane
CID 13170081
(3R,3aR,6R,6aS)-3,6-diethoxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan
CID 163360489
3,4-diethoxyoxolane
CID 14307969
3-(diethoxymethyl)-2-ethoxyoxolane
CID 11579424
[(1R,2R)-2-ethoxycyclohexyl]-trimethylsilane
CID 91703112
trans-(1S,2R)-1-ethoxy-2-propylcyclohexane
CID 94034878
2-ethoxy-3-(1-ethoxyethyl)oxolane
CID 11769288
3,4-diethoxydioxetane
CID 59986645
(1S,2R,4S,5S)-1,2,3,4,5-pentaethoxycyclohexane
CID 118346921
3-ethoxy-1-azabicyclo[2.2.1]heptane
CID 19848684

Frequently Asked Questions

What is the IUPAC name of (2R)-3-ethoxy-2-iodooxolane?
The IUPAC name of (2R)-3-ethoxy-2-iodooxolane (CID 146185883) is (2R)-3-ethoxy-2-iodooxolane.
What is the SMILES notation for (2R)-3-ethoxy-2-iodooxolane?
The canonical SMILES for (2R)-3-ethoxy-2-iodooxolane is CCOC1CCO[C@@H]1I.
What is the InChIKey of (2R)-3-ethoxy-2-iodooxolane?
The InChIKey is UQLAASNMYOYFQN-GDVGLLTNSA-N. The full InChI is InChI=1S/C6H11IO2/c1-2-8-5-3-4-9-6(5)7/h5-6H,2-4H2,1H3/t5?,6-/m0/s1.
What are the key properties of (2R)-3-ethoxy-2-iodooxolane?
(2R)-3-ethoxy-2-iodooxolane has a molecular weight of 242.06 g/mol, XLogP of 1.57, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-3-ethoxy-2-iodooxolane is sourced from PubChem (CID 146185883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).