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≥99% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 7 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 508809696 |
|---|---|
| Kanonisches Lächeln | C1=CC(=CC=C1CBr)[N+](=O)[O-] |
| IUPAC Name | 1-(bromomethyl)-4-nitrobenzene |
| InChIKey | VOLRSQPSJGXRNJ-UHFFFAOYSA-N |
| INCHI | 1S/C7H6BrNO2/c8-5-6-1-3-7(4-2-6)9(10)11/h1-4H,5H2 |
| Isomere SMILES | C1=CC(=CC=C1CBr)[N+](=O)[O-] |
| WGK Deutschland | 3 |
| RTECS | XS7967000 |
| UN-Nummer | 3261 |
| Verpackungsgruppe | II |
| Molekulargewicht | 216.03 |
| Beilstein | 5334 |
| Reaxy-Rn | 742796 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=742796&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 |
| Klasse | Benzene and substituted derivatives |
| Subclass | Nitrobenzenes |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Nitrobenzenes |
| Alternative Parents | Nitroaromatic compounds Benzyl bromides Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organopnictogen compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives Alkyl bromides |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Nitrobenzene - Nitroaromatic compound - Benzyl halide - Benzyl bromide - C-nitro compound - Organic nitro compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Alkyl bromide - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organobromide - Organopnictogen compound - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Aromatic homomonocyclic compound |
| Beschreibung | This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group. |
| External Descriptors | C-nitro compound - benzyl bromides |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Datum | Artikel |
|---|---|---|---|
| Certificate of Analysis | Sep 03, 2026 | N100516 | |
| Certificate of Analysis | Jun 05, 2025 | N100516 | |
| Certificate of Analysis | May 10, 2025 | N100516 | |
| Certificate of Analysis | May 10, 2025 | N100516 | |
| Certificate of Analysis | May 10, 2025 | N100516 | |
| Certificate of Analysis | May 10, 2025 | N100516 | |
| Certificate of Analysis | May 10, 2025 | N100516 | |
| Certificate of Analysis | May 10, 2025 | N100516 | |
| Certificate of Analysis | May 10, 2025 | N100516 | |
| Certificate of Analysis | May 10, 2025 | N100516 | |
| Certificate of Analysis | May 10, 2025 | N100516 | |
| Certificate of Analysis | Oct 09, 2024 | N100516 | |
| Certificate of Analysis | Oct 09, 2024 | N100516 | |
| Certificate of Analysis | Apr 30, 2024 | N100516 | |
| Certificate of Analysis | Apr 30, 2024 | N100516 | |
| Certificate of Analysis | Apr 30, 2024 | N100516 | |
| Certificate of Analysis | Oct 16, 2023 | N100516 | |
| Certificate of Analysis | Jul 12, 2023 | N100516 | |
| Certificate of Analysis | May 04, 2023 | N100516 | |
| Certificate of Analysis | May 04, 2023 | N100516 | |
| Certificate of Analysis | May 04, 2023 | N100516 | |
| Certificate of Analysis | Jan 16, 2023 | N100516 | |
| Certificate of Analysis | Jan 16, 2023 | N100516 | |
| Certificate of Analysis | Jan 16, 2023 | N100516 | |
| Certificate of Analysis | Jan 10, 2022 | N100516 | |
| Certificate of Analysis | Jan 10, 2022 | N100516 | |
| Certificate of Analysis | Jan 10, 2022 | N100516 | |
| Certificate of Analysis | Jan 10, 2022 | N100516 |
| Löslichkeit | It hydrolyzes in water. Soluble in alcohol and ether.Soluble in benzene. |
|---|---|
| Empfindlichkeit | light sensitive ;air sensitive |
| Schmelzpunkt (°C) | 96-101℃ |
| Molekulargewicht | 216.030 g/mol |
| XLogP3 | 2.700 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 214.958 Da |
| Monoisotopic Mass | 214.958 Da |
| Topological Polar Surface Area | 45.800 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 138.000 |
| 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 |