Determine the necessary mass, volume, or concentration for preparing a solution.
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Moligand™, ≥98% Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Protected from light,Store at -20°C,Desiccated 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 2 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| ALogP | 5.3 |
|---|
| Pubchem Sid | 504750757 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504750757 |
| 정식 스마일 | C1=CC(=C(C=C1Cl)Cl)COC(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl |
| IUPAC Name | 1-[2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethyl]imidazole |
| InChIKey | BYBLEWFAAKGYCD-UHFFFAOYSA-N |
| INCHI | 1S/C18H14Cl4N2O/c19-13-2-1-12(16(21)7-13)10-25-18(9-24-6-5-23-11-24)15-4-3-14(20)8-17(15)22/h1-8,11,18H,9-10H2 |
| 이성체 SMILES | C1=CC(=C(C=C1Cl)Cl)COC(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl |
| 분자량 | 416.14 |
| Reaxy-Rn | 965511 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=965511&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 | Benzenoids |
| 분류 | Benzene and substituted derivatives |
| Subclass | Benzylethers |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Benzylethers |
| Alternative Parents | Dichlorobenzenes N-substituted imidazoles Aryl chlorides Heteroaromatic compounds Dialkyl ethers Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteromonocyclic compounds |
| Substituents | Benzylether - 1,3-dichlorobenzene - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - N-substituted imidazole - Imidazole - Azole - Heteroaromatic compound - Ether - Dialkyl ether - Organoheterocyclic compound - Azacycle - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound |
| 설명 | This compound belongs to the class of organic compounds known as benzylethers. These are aromatic ethers with the general formula ROCR' (R = alkyl, aryl; R'=benzene). |
| External Descriptors | a small molecule |
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Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | 날짜 | 항목 |
|---|---|---|---|
| Certificate of Analysis | Jul 22, 2026 | M303130 | |
| Certificate of Analysis | Jul 22, 2026 | M303130 | |
| Certificate of Analysis | Jul 22, 2026 | M303130 | |
| Certificate of Analysis | Jul 22, 2026 | M303130 | |
| Certificate of Analysis | May 11, 2026 | M303130 | |
| Certificate of Analysis | May 11, 2026 | M303130 | |
| Certificate of Analysis | Feb 27, 2024 | M303130 | |
| Certificate of Analysis | Feb 27, 2024 | M303130 | |
| Certificate of Analysis | Feb 27, 2024 | M303130 | |
| Certificate of Analysis | Feb 27, 2024 | M303130 | |
| Certificate of Analysis | Feb 27, 2024 | M303130 | |
| Certificate of Analysis | Feb 27, 2024 | M303130 | |
| Certificate of Analysis | Feb 27, 2024 | M303130 | |
| Certificate of Analysis | Feb 27, 2024 | M303130 | |
| Certificate of Analysis | Jul 10, 2023 | M303130 | |
| Certificate of Analysis | Jul 10, 2023 | M303130 | |
| Certificate of Analysis | Apr 27, 2023 | M303130 | |
| Certificate of Analysis | Apr 27, 2023 | M303130 |
| 용해성 | Freely soluble in alcohols or acetone. Also soluble in DMF or chloroform. |
|---|---|
| 감도 | Light sensitive |
| 녹는점(°C) | 83-97°C |
| 분자량 | 416.100 g/mol |
| XLogP3 | 5.300 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 6 |
| Exact Mass | 415.983 Da |
| Monoisotopic Mass | 413.986 Da |
| Topological Polar Surface Area | 27.100 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 417.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
Our grade selection guide covers purity, stabilizer status, and application suitability for all variants in our catalog.
View Moligand™ grade guide →