3-Iodooxetane

C₃H₅IOCAS 26272-85-5183.98 g/mol

Open in Covalent MOL file

Alkyl halide Ether

Properties

Molecular formula: C₃H₅IO
Molar mass: 183.98 g/mol
Exact mass: 183.9385 Da
logP: 0.82Crippen estimate
Polar surface area: 9.2 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 0

Hazards

Warning

H226 Flammable liquid and vapor14.6% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation97.9% of notifiers

Aggregated from 48 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501

Identifiers

CAS number

26272-85-5

SMILES

IC1COC1

InChIKey

KBEIFKMKVCDETC-UHFFFAOYSA-N

InChI

InChI=1S/C3H5IO/c4-3-1-5-2-3/h3H,1-2H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

2 names

Oxetane, 3-iodo-
Propane, 1,3-epoxy-2-iodo-

Work with 3-Iodooxetane

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Tetrahydro-3-iodofuran121138-01-056 % similar 4-Iodotetrahydro-2H-pyran25637-18-744 % similar Iodocyclopentane1556-18-935 % similar 3,6-Dioxabicyclo[3.1.0]hexane285-69-835 % similar Triglycidylglycerol13236-02-733 % similar 3-Oxetanamine21635-88-133 % similar Diglycidyl ether2238-07-533 % similar 3-Bromooxetane39267-79-333 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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