4-Iodo-2-methoxynicotinaldehyde

C₇H₆INO₂CAS 158669-26-2263.03 g/mol

Open in Covalent MOL file

Aldehyde Aryl halide Ether

Properties

Molecular formula: C₇H₆INO₂
Molar mass: 263.03 g/mol
Exact mass: 262.9443 Da
logP: 1.51Crippen estimate
Polar surface area: 39.2 Å²
H-bond donors / acceptors: 0 / 3
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

158669-26-2

SMILES

COC1=NC=CC(=C1C=O)I

InChIKey

GNBKAOHTTIVAMT-UHFFFAOYSA-N

InChI

InChI=1S/C7H6INO2/c1-11-7-5(4-10)6(8)2-3-9-7/h2-4H,1H3

Weigh it out

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

Names and synonyms

1 names

4-Iodo-2-methoxypyridine-3-carboxaldehyde

Work with 4-Iodo-2-methoxynicotinaldehyde

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

2-Fluoro-4-iodopyridine-3-carbaldehyde153034-82-354 % similar 2-Chloro-4-iodopyridine-3-carbaldehyde153034-90-354 % similar 3-Iodo-2-methoxypyridine112197-15-650 % similar 2-Methoxypyridine-3-carbaldehyde71255-09-950 % similar 2-Methoxypyridine-4-carbaldehyde72716-87-143 % similar 3-Iodo-4-methoxybenzaldehyde2314-37-641 % similar 2,6-Dimethoxybenzaldehyde3392-97-041 % similar 5-Methoxypicolinaldehyde22187-96-840 % similar

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

Same formula

3-Iodoisonicotinic acid methyl ester188677-49-8 2-Amino-4-iodo-benzoic acid20776-54-9 2-Amino-3-iodobenzoic acid20776-55-0 4-Amino-3-iodobenzoic acid2122-63-6 4-Iodo-2-nitrotoluene41252-97-5 1-Iodo-2-methyl-4-nitrobenzene5326-38-5 4-Iodo-3-nitrotoluene5326-39-6 2-Amino-5-iodobenzoic acid5326-47-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook