5-Iodo-2,4-dimethoxypyrimidine

C₆H₇IN₂O₂CAS 52522-99-3266.04 g/mol

Open in Covalent MOL file

Aryl halide Ether

Properties

Molecular formula: C₆H₇IN₂O₂
Molar mass: 266.04 g/mol
Exact mass: 265.9552 Da
logP: 1.10Crippen estimate
Polar surface area: 44.2 Å²
H-bond donors / acceptors: 0 / 4
Rotatable bonds: 2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

52522-99-3

SMILES

COC1=NC(=NC=C1I)OC

InChIKey

KNTMOGOYRYYUIE-UHFFFAOYSA-N

InChI

InChI=1S/C6H7IN2O2/c1-10-5-4(7)3-8-6(9-5)11-2/h3H,1-2H3

Weigh it out

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

Work with 5-Iodo-2,4-dimethoxypyrimidine

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

5-Bromo-2,4-dimethoxypyrimidine56686-16-956 % similar 2,4-Dimethoxypyrimidine-5-carbaldehyde52606-02-751 % similar (2,4-Dimethoxypyrimidin-5-yl)boronic acid89641-18-951 % similar 5-Fluoro-2-methoxy-4(3H)-pyrimidinone1480-96-244 % similar 5-Bromo-3-iodo-2-methoxypyridine578007-66-644 % similar 3-Iodo-2-methoxypyridine112197-15-644 % similar 5-Bromo-2-iodo-3-methoxypyrazine476622-89-642 % similar 5-Bromo-2-methoxypyrimidine14001-66-241 % similar

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

Same formula

4-Iodo-1-methyl-1H-pyrazole-5-carboxylic acid methyl ester75092-26-1

Elsewhere

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