4-(Iodomethyl)tetrahydro-2H-pyran

C₆H₁₁IOCAS 101691-94-5226.06 g/mol

Open in Covalent MOL file

Alkyl halide Ether

Properties

Molecular formula: C₆H₁₁IO
Molar mass: 226.06 g/mol
Exact mass: 225.9855 Da
logP: 1.85Crippen estimate
Polar surface area: 9.2 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 1

Identifiers

CAS number

101691-94-5

SMILES

C1COCCC1CI

InChIKey

MQLFSPBSNWUXSO-UHFFFAOYSA-N

InChI

InChI=1S/C6H11IO/c7-5-6-1-3-8-4-2-6/h6H,1-5H2

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Names and synonyms

1 names

4-(Iodomethyl)oxane

Work with 4-(Iodomethyl)tetrahydro-2H-pyran

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-Bromomethyltetrahydropyran125552-89-845 % similar 4-Aminomethyltetrahydropyran130290-79-845 % similar (Tetrahydro-2H-pyran-4-yl)methanol14774-37-945 % similar 2-(Iodomethyl)oxetane121138-00-939 % similar 4-Chlorotetrahydro-2H-pyran1768-64-536 % similar Tetrahydro-2H-pyran-4-ol2081-44-936 % similar Diisoamyl ether544-01-436 % similar (3R)-Tetrahydro-3-furanmethanamine1048962-82-836 % similar

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

Elsewhere

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