≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships Normal Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Canonical Smiles | C1=CC=C(C=C1)COC2=C(C=C(N=C2Cl)C=O)I |
|---|---|
| IUPAC Name | 6-chloro-4-iodo-5-phenylmethoxypyridine-2-carbaldehyde |
| InChIKey | ANPGINPOPHSNSB-UHFFFAOYSA-N |
| INCHI | 1S/C13H9ClINO2/c14-13-12(11(15)6-10(7-17)16-13)18-8-9-4-2-1-3-5-9/h1-7H,8H2 |
| Isomeric SMILES | C1=CC=C(C=C1)COC2=C(C=C(N=C2Cl)C=O)I |
| PubChem CID | 66545173 |
| Molecular Weight | 373.58 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Class | Pyridines and derivatives |
| Subclass | Pyridinecarboxylic acids and derivatives |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Pyridinecarboxylic acids and derivatives |
| Alternative Parents | Pyridine carboxaldehydes Polyhalopyridines O-alkylpyrimidines Aryl-aldehydes Alkyl aryl ethers 2-halopyridines Benzene and substituted derivatives Secondary ketimines Heteroaromatic compounds Vinyl iodides Vinyl chlorides Propargyl-type 1,3-dipolar organic compounds Iodoalkenes Chloroalkenes Azacyclic compounds Organopnictogen compounds Organoiodides Organochlorides Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteromonocyclic compounds |
| Substituents | Pyridine carboxylic acid or derivatives - O-alkylpyrimidine - Polyhalopyridine - 2-pyridine carboxaldehyde - 2-halopyridine - Aryl-aldehyde - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Secondary ketimine - Ketimine - Azacycle - Iodoalkene - Chloroalkene - Haloalkene - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Vinyl iodide - Vinyl halide - Vinyl chloride - Ether - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organoiodide - Organochloride - Organohalogen compound - Imine - Aldehyde - Aromatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as pyridinecarboxylic acids and derivatives. These are compounds containing a pyridine ring bearing a carboxylic acid group or a derivative thereof. |
| External Descriptors | Not available |
| Molecular Weight | 373.570 g/mol |
|---|---|
| XLogP3 | 3.700 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 4 |
| Exact Mass | 372.937 Da |
| Monoisotopic Mass | 372.937 Da |
| Topological Polar Surface Area | 39.200 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 274.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
