2-(Iodomethyl)oxetane

C₄H₇IOCAS 121138-00-9198.00 g/mol

Open in Covalent MOL file

Alkyl halide Ether

Properties

Molecular formula: C₄H₇IO
Molar mass: 198.00 g/mol
Exact mass: 197.9542 Da
logP: 1.21Crippen estimate
Polar surface area: 9.2 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 1

Identifiers

CAS number

121138-00-9

SMILES

C1COC1CI

InChIKey

JVPHNTROOBLPKR-UHFFFAOYSA-N

InChI

InChI=1S/C4H7IO/c5-3-4-1-2-6-4/h4H,1-3H2

Weigh it out

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

Work with 2-(Iodomethyl)oxetane

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

4-(Iodomethyl)tetrahydro-2H-pyran101691-94-539 % similar 2-(Chloromethyl)tetrahydrofuran3003-84-731 % similar Tetrahydrofurfurylamine4795-29-331 % similar (R)-(-)-Tetrahydrofurfurylamine7202-43-931 % similar Tetrahydrofurfuryl alcohol97-99-431 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Tetrahydro-3-iodofuran121138-01-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook