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.
Protected from light,Store at -20°C Ships Ice chest + Ice pads 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 | 488191483 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488191483 |
| Canonical Smiles | CC1=C(C2=C(N1C3=CC=C(C=C3)OC)C=C(C=C2)O)[N+](=O)[O-] |
| IUPAC Name | 1-(4-methoxyphenyl)-2-methyl-3-nitroindol-6-ol |
| InChIKey | VVZNWYXIOADGSW-UHFFFAOYSA-N |
| INCHI | 1S/C16H14N2O4/c1-10-16(18(20)21)14-8-5-12(19)9-15(14)17(10)11-3-6-13(22-2)7-4-11/h3-9,19H,1-2H3 |
| Isomeric SMILES | CC1=C(C2=C(N1C3=CC=C(C=C3)OC)C=C(C=C2)O)[N+](=O)[O-] |
| Molecular Weight | 298.29 |
| Reaxy-Rn | 5825601 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5825601&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 | Pyrroles |
| Subclass | Substituted pyrroles |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Phenylpyrroles |
| Alternative Parents | Hydroxyindoles Indoles Methoxyanilines Phenoxy compounds Anisoles Nitroaromatic compounds Methoxybenzenes 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Heteroaromatic compounds Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic zwitterions Hydrocarbon derivatives Organonitrogen compounds Organopnictogen compounds Organic oxides |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | 1-phenylpyrrole - Hydroxyindole - Methoxyaniline - Indole or derivatives - Indole - Phenol ether - Phenoxy compound - Methoxybenzene - Nitroaromatic compound - Anisole - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Ether - Azacycle - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxygen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Organic nitrogen compound - Organic zwitterion - Organic oxide - Aromatic heteropolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as phenylpyrroles. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrrole ring through a CC or CN bond. |
| 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 | Feb 05, 2026 | I287101 | |
| Certificate of Analysis | Feb 05, 2026 | I287101 | |
| Certificate of Analysis | Feb 05, 2026 | I287101 | |
| Certificate of Analysis | Feb 05, 2026 | I287101 | |
| Certificate of Analysis | Feb 05, 2026 | I287101 | |
| Certificate of Analysis | Feb 05, 2026 | I287101 | |
| Certificate of Analysis | Feb 05, 2026 | I287101 | |
| Certificate of Analysis | Feb 05, 2026 | I287101 | |
| Certificate of Analysis | Feb 05, 2026 | I287101 | |
| Certificate of Analysis | Feb 05, 2026 | I287101 | |
| Certificate of Analysis | Feb 05, 2026 | I287101 | |
| Certificate of Analysis | Feb 05, 2026 | I287101 | |
| Certificate of Analysis | Feb 05, 2026 | I287101 | |
| Certificate of Analysis | Feb 05, 2026 | I287101 |
| Solubility | Solvent:DMSO, Max Conc. mg/mL: 29.83, Max Conc. mM: 100 |
|---|---|
| Sensitivity | Light Sensitive,Heat Sensitive |
| Melt Point(°C) | 266 °C(dec.) |
| Molecular Weight | 298.290 g/mol |
| XLogP3 | 3.500 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 298.095 Da |
| Monoisotopic Mass | 298.095 Da |
| Topological Polar Surface Area | 80.200 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 405.000 |
| 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 |