Determine the necessary mass, volume, or concentration for preparing a solution.
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≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at 2-8°C Ships Wet ice 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.
| Pubchem Sid | 488183042 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488183042 |
| Canonical Smiles | C1C2=CC=CC=C2N(C1=O)C3=C(C=CC=C3Cl)Cl |
| IUPAC Name | 1-(2,6-dichlorophenyl)-3H-indol-2-one |
| InChIKey | JCICIFOYVSPMHG-UHFFFAOYSA-N |
| INCHI | 1S/C14H9Cl2NO/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(17)18/h1-7H,8H2 |
| Isomeric SMILES | C1C2=CC=CC=C2N(C1=O)C3=C(C=CC=C3Cl)Cl |
| RTECS | NM3259200 |
| Molecular Weight | 278.133 |
| Reaxy-Rn | 1538309 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1538309&ln= |
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 | Indoles and derivatives |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Indoles and derivatives |
| Alternative Parents | Dichlorobenzenes Aryl chlorides Tertiary carboxylic acid amides Lactams Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Indole or derivatives - 1,3-dichlorobenzene - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Carboxamide group - Lactam - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as indoles and derivatives. These are organic compounds containing an indole, which is a bicyclic ring system made up of a six-membered benzene ring fused to a five-membered nitrogen-containing pyrrole ring. |
| External Descriptors | Not available |
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Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
| Certificate of Analysis | Jan 14, 2025 | D141504 | |
| Certificate of Analysis | Jan 14, 2025 | D141504 | |
| Certificate of Analysis | Jan 14, 2025 | D141504 | |
| Certificate of Analysis | Jan 14, 2025 | D141504 | |
| Certificate of Analysis | Jan 14, 2025 | D141504 | |
| Certificate of Analysis | Jan 14, 2025 | D141504 | |
| Certificate of Analysis | Jan 14, 2025 | D141504 | |
| Certificate of Analysis | Jan 14, 2025 | D141504 | |
| Certificate of Analysis | Feb 09, 2023 | D141504 | |
| Certificate of Analysis | Dec 06, 2022 | D141504 |
| Solubility | Soluble in Toluene |
|---|---|
| Melt Point(°C) | 127 °C |
| Molecular Weight | 278.100 g/mol |
| XLogP3 | 3.800 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 1 |
| Exact Mass | 277.006 Da |
| Monoisotopic Mass | 277.006 Da |
| Topological Polar Surface Area | 20.300 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 326.000 |
| 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 |