Determine the necessary mass, volume, or concentration for preparing a solution.
≥98%(T) 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.
| Pubchem Sid | 488183867 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488183867 |
| Canonical Smiles | COC1=CC=C(C=C1)NC2=CC=C(C=C2)N |
| IUPAC Name | 4-N-(4-methoxyphenyl)benzene-1,4-diamine |
| InChIKey | RBLUJIWKMSZIMK-UHFFFAOYSA-N |
| INCHI | 1S/C13H14N2O/c1-16-13-8-6-12(7-9-13)15-11-4-2-10(14)3-5-11/h2-9,15H,14H2,1H3 |
| Isomeric SMILES | COC1=CC=C(C=C1)NC2=CC=C(C=C2)N |
| PubChem CID | 66869 |
| Molecular Weight | 214.27 |
| Reaxy-Rn | 2213141 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
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View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| Class | Phenol ethers |
| Subclass | Aminophenyl ethers |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Aminophenyl ethers |
| Alternative Parents | Methoxyanilines Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers Secondary amines Primary amines Organopnictogen compounds Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Aminophenyl ether - Methoxyaniline - Phenoxy compound - Anisole - Aniline or substituted anilines - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Ether - Secondary amine - Primary amine - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organopnictogen compound - Organic oxygen compound - Amine - Hydrocarbon derivative - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as aminophenyl ethers. These are aromatic compounds that contain a phenol ether, which carries an amine group on the benzene ring. |
| External Descriptors | Not available |
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 | Apr 23, 2024 | V162976 | |
| Certificate of Analysis | Apr 23, 2024 | V162976 | |
| Certificate of Analysis | Dec 08, 2022 | V162976 | |
| Certificate of Analysis | Dec 08, 2022 | V162976 | |
| Certificate of Analysis | Dec 08, 2022 | V162976 | |
| Certificate of Analysis | Dec 08, 2022 | V162976 |
| Boil Point(°C) | 210°C/4mmHg(lit.) |
|---|---|
| Melt Point(°C) | 101 °C |
| Molecular Weight | 214.260 g/mol |
| XLogP3 | 2.500 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 214.111 Da |
| Monoisotopic Mass | 214.111 Da |
| Topological Polar Surface Area | 47.300 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 194.000 |
| 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 |