≥99% 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 2 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Usually used to study the mechanism of both the alkaline and acidic hydrolysis of tinidazole.
| Pubchem Sid | 488181733 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488181733 |
| Canonical Smiles | CC1=NC=C(N1)[N+](=O)[O-] |
| IUPAC Name | 2-methyl-5-nitro-1H-imidazole |
| InChIKey | FFYTTYVSDVWNMY-UHFFFAOYSA-N |
| INCHI | 1S/C4H5N3O2/c1-3-5-2-4(6-3)7(8)9/h2H,1H3,(H,5,6) |
| Isomeric SMILES | CC1=NC=C(N1)[N+](=O)[O-] |
| Molecular Weight | 127.10 |
| Beilstein | 4032 |
| Reaxy-Rn | 4032 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4032&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 | Azoles |
| Subclass | Imidazoles |
| Intermediate Tree Nodes | Substituted imidazoles |
| Direct Parent | Nitroimidazoles |
| Alternative Parents | Nitroaromatic compounds Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic zwitterions Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteromonocyclic compounds |
| Substituents | Nitroaromatic compound - Nitroimidazole - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Organic 1,3-dipolar compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic zwitterion - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as nitroimidazoles. These are compounds containing an imidazole ring which bears a nitro group. |
| 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 |
|---|---|---|---|
 L2404028 | Certificate of Analysis | Sep 01, 2026 | M137715 |
| B2315303 | Certificate of Analysis | Aug 03, 2026 | M137715 |
| B2315304 | Certificate of Analysis | Aug 03, 2026 | M137715 |
| B2315305 | Certificate of Analysis | Aug 03, 2026 | M137715 |
| B2315306 | Certificate of Analysis | Aug 03, 2026 | M137715 |
| B2315307 | Certificate of Analysis | Aug 03, 2026 | M137715 |
| I2423625 | Certificate of Analysis | Jul 03, 2026 | M137715 |
| F2519058 | Certificate of Analysis | Jun 21, 2025 | M137715 |
| K2110031 | Certificate of Analysis | May 09, 2025 | M137715 |
| K2110029 | Certificate of Analysis | May 09, 2025 | M137715 |
| E1511020 | Certificate of Analysis | Sep 13, 2024 | M137715 |
| H2426410 | Certificate of Analysis | Aug 05, 2024 | M137715 |
| H2426412 | Certificate of Analysis | Aug 05, 2024 | M137715 |
| H2426411 | Certificate of Analysis | Aug 05, 2024 | M137715 |
| I2201701 | Certificate of Analysis | Jun 18, 2024 | M137715 |
| I2201702 | Certificate of Analysis | Jun 18, 2024 | M137715 |
| I2201774 | Certificate of Analysis | Jun 18, 2024 | M137715 |
| D2428375 | Certificate of Analysis | Mar 13, 2024 | M137715 |
| A2226030 | Certificate of Analysis | Nov 02, 2023 | M137715 |
| B2315326 | Certificate of Analysis | Feb 04, 2023 | M137715 |
| B2315059 | Certificate of Analysis | Feb 04, 2023 | M137715 |
| I2201707 | Certificate of Analysis | Jun 20, 2022 | M137715 |
| Solubility | Slightly soluble in ethanol, easily soluble in diluted acid and diluted alkali. |
|---|---|
| Flash Point(°F) | 383°F |
| Flash Point(°C) | 195°C |
| Boil Point(°C) | 399° |
| Melt Point(°C) | 251-255° |
| Molecular Weight | 127.100 g/mol |
| XLogP3 | 0.300 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 0 |
| Exact Mass | 127.038 Da |
| Monoisotopic Mass | 127.038 Da |
| Topological Polar Surface Area | 74.500 Ų |
| Heavy Atom Count | 9 |
| Formal Charge | 0 |
| Complexity | 121.000 |
| 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 |
| 1. Jun Li, Zhenhai Xia, Xiaowei Wang, Cheng Feng, Qingcheng Zhang, Xi'an Chen, Yun Yang, Shun Wang, Huile Jin. (2023) Distinguished Roles of Nitrogen-Doped Sp2 and Sp3 Hybridized Carbon on Extraordinary Supercapacitance in Acidic Aqueous Electrolyte. ADVANCED MATERIALS, [PMID:38102494] [10.1002/adma.202310422] |
| 2. Yongjie Zhang, Ning Feng, Shujin Zhou, Xia Xin. (2021) Fluorescent nanocomposites based on gold nanoclusters for metal ion detection and white light emitting diodes. Nanoscale, 13 (7): (4140-4150). [PMID:33575692] [10.1039/D0NR09141C] |
