≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships 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.
Product Describtion:
2-Cyanobenzophenone, also known as 2-benzoylbenzonitrile, is a carbonyl-ene-nitrile compound. Its crystal structure belongs to the monoclinic space group,P21/c. 2-Cyanobenzophenone reacts with furan to form the corresponding adduct. Its reduction under electrochemical condition led to the formation of 2-t-butylbenzophenone, 3-t-butyl-3-phenylphthalide and 6-t-butyl-3-phenylphthalide.2-Cyanobenzophenone (2-benzoylbenzonitrile) may be used in the preparation of 3-phenyl-3H-isobenzofuran-1-ylidenamine.
Product Application:
2-Cyanobenzophenone (2-benzoylbenzonitrile) may be used in the preparation of 3-phenyl-3H-isobenzofuran-1-ylidenamine.
| Kanonisches Lächeln | C1=CC=C(C=C1)C(=O)C2=CC=CC=C2C#N |
|---|---|
| IUPAC Name | 2-benzoylbenzonitrile |
| InChIKey | XPBIJHFBORWDCM-UHFFFAOYSA-N |
| INCHI | 1S/C14H9NO/c15-10-12-8-4-5-9-13(12)14(16)11-6-2-1-3-7-11/h1-9H |
| Isomere SMILES | C1=CC=C(C=C1)C(=O)C2=CC=CC=C2C#N |
| WGK Deutschland | 3 |
| Molekulargewicht | 207.23 |
| Reaxy-Rn | 2836193 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2836193&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 | Benzophenones |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Benzophenones |
| Alternative Parents | Diphenylmethanes Aryl-phenylketones Benzoyl derivatives Benzonitriles Nitriles Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Benzophenone - Diphenylmethane - Aryl-phenylketone - Benzonitrile - Aryl ketone - Benzoyl - Ketone - Nitrile - Carbonitrile - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Cyanide - Organic oxygen compound - Aromatic homomonocyclic compound |
| Beschreibung | This compound belongs to the class of organic compounds known as benzophenones. These are organic compounds containing a ketone attached to two phenyl groups. |
| External Descriptors | Not available |
| Schmelzpunkt (°C) | 82-87 °C |
|---|---|
| Molekulargewicht | 207.230 g/mol |
| XLogP3 | 3.000 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 207.068 Da |
| Monoisotopic Mass | 207.068 Da |
| Topological Polar Surface Area | 40.900 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 295.000 |
| 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 |
