≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature,Desiccated 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 | 488199962 |
|---|---|
| Canonical Smiles | C1CC(C1)(C#N)C2=CC=C(C=C2)[N+](=O)[O-] |
| IUPAC Name | 1-(4-nitrophenyl)cyclobutane-1-carbonitrile |
| InChIKey | JHOHTGSVQASAEI-UHFFFAOYSA-N |
| INCHI | 1S/C11H10N2O2/c12-8-11(6-1-7-11)9-2-4-10(5-3-9)13(14)15/h2-5H,1,6-7H2 |
| Isomeric SMILES | C1CC(C1)(C#N)C2=CC=C(C=C2)[N+](=O)[O-] |
| Molecular Weight | 202.21 |
| Reaxy-Rn | 14289105 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=14289105&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 |
| Class | Benzene and substituted derivatives |
| Subclass | Nitrobenzenes |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Nitrobenzenes |
| Alternative Parents | Nitroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Nitriles Organic salts Organic oxides Hydrocarbon derivatives Organic cations |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Nitrobenzene - Nitroaromatic compound - C-nitro compound - Organic nitro compound - Carbonitrile - Nitrile - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic nitrogen compound - Organonitrogen compound - Organic oxygen compound - Organic salt - Cyanide - Hydrocarbon derivative - Organic oxide - Organic cation - Aromatic homomonocyclic compound |
| Description | 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 | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 C23241212 | Certificate of Analysis | Jan 19, 2026 | N302275 |
| C23241214 | Certificate of Analysis | Jan 19, 2026 | N302275 |
| C23241249 | Certificate of Analysis | Jan 19, 2026 | N302275 |
| C23241250 | Certificate of Analysis | Jan 19, 2026 | N302275 |
| C23241259 | Certificate of Analysis | Jan 19, 2026 | N302275 |
| C23241260 | Certificate of Analysis | Jan 19, 2026 | N302275 |
| I2127232 | Certificate of Analysis | Jul 11, 2024 | N302275 |
| I2127356 | Certificate of Analysis | Jul 11, 2024 | N302275 |
| I2127357 | Certificate of Analysis | Jul 11, 2024 | N302275 |
| C2324260 | Certificate of Analysis | Feb 10, 2023 | N302275 |
| Molecular Weight | 202.210 g/mol |
|---|---|
| XLogP3 | 2.300 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 202.074 Da |
| Monoisotopic Mass | 202.074 Da |
| Topological Polar Surface Area | 69.600 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 300.000 |
| 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 |
