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≥98% 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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Sonrisas canónicas | C1C2CC(C1C=C2)C#N |
|---|---|
| IUPAC Name | bicyclo[2.2.1]hept-5-ene-2-carbonitrile |
| InChIKey | BMAXQTDMWYDIJX-UHFFFAOYSA-N |
| INCHI | 1S/C8H9N/c9-5-8-4-6-1-2-7(8)3-6/h1-2,6-8H,3-4H2 |
| Isómeros SMILES | C1C2CC(C1C=C2)C#N |
| WGK Alemania | 3 |
| RTECS | RB7930000 |
| Peso molecular | 119.16 |
| Reaxy-Rn | 2042173 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2042173&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 | Organic nitrogen compounds |
| Clase | Organonitrogen compounds |
| Subclass | Organic cyanides |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Nitriles |
| Alternative Parents | Organopnictogen compounds Hydrocarbon derivatives |
| Molecular Framework | Aliphatic homopolycyclic compounds |
| Substituents | Nitrile - Carbonitrile - Organopnictogen compound - Hydrocarbon derivative - Aliphatic homopolycyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as nitriles. These are compounds having the structure RC#N; thus C-substituted derivatives of hydrocyanic acid, HC#N. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Fecha | Articulo |
|---|---|---|---|
| Certificate of Analysis | Jul 09, 2024 | N111452 | |
| Certificate of Analysis | Jul 09, 2024 | N111452 | |
| Certificate of Analysis | Jul 09, 2024 | N111452 | |
| Certificate of Analysis | Jul 09, 2024 | N111452 | |
| Certificate of Analysis | Dec 13, 2022 | N111452 | |
| Certificate of Analysis | Mar 23, 2022 | N111452 |
| Índice de refracción | 1.488(lit.) |
|---|---|
| Punto de inflamación (°F) | 150.8 °F |
| Punto de inflamación (°C) | 66°C(lit.) |
| Punto de ebullición (°C) | 82-86°C/10mmHg |
| Punto de fusión (°C) | 10°C |
| Peso molecular | 119.160 g/mol |
| XLogP3 | 1.400 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 0 |
| Exact Mass | 119.073 Da |
| Monoisotopic Mass | 119.073 Da |
| Topological Polar Surface Area | 23.800 Ų |
| Heavy Atom Count | 9 |
| Formal Charge | 0 |
| Complexity | 196.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 3 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |