≥98%(GC) 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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 488180841 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488180841 |
| Canonical Smiles | C1=CC=C2C(=C1)C=CC=C2CC#N |
| IUPAC Name | 2-naphthalen-1-ylacetonitrile |
| InChIKey | OQRMWUNUKVUHQO-UHFFFAOYSA-N |
| INCHI | 1S/C12H9N/c13-9-8-11-6-3-5-10-4-1-2-7-12(10)11/h1-7H,8H2 |
| Isomeric SMILES | C1=CC=C2C(=C1)C=CC=C2CC#N |
| Molecular Weight | 167.21 |
| Reaxy-Rn | 1101012 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1101012&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 | Naphthalenes |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Naphthalenes |
| Alternative Parents | Nitriles Organopnictogen compounds Hydrocarbon derivatives |
| Molecular Framework | Aromatic homopolycyclic compounds |
| Substituents | Naphthalene - Nitrile - Carbonitrile - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic homopolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as naphthalenes. These are compounds containing a naphthalene moiety, which consists of two fused benzene rings. |
| 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 |
|---|---|---|---|
 H2217044 | Certificate of Analysis | Jun 08, 2026 | N158914 |
| J1924263 | Certificate of Analysis | Aug 04, 2023 | N158914 |
| J22111322 | Certificate of Analysis | Sep 14, 2022 | N158914 |
| J22111324 | Certificate of Analysis | Sep 14, 2022 | N158914 |
| J22111343 | Certificate of Analysis | Sep 14, 2022 | N158914 |
| J22111344 | Certificate of Analysis | Sep 14, 2022 | N158914 |
| Refractive Index | 1.6192 |
|---|---|
| Flash Point(°F) | 230°F |
| Flash Point(°C) | >110℃ |
| Boil Point(°C) | 180-182°/9mm |
| Melt Point(°C) | 33-35℃ |
| Molecular Weight | 167.210 g/mol |
| XLogP3 | 2.900 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 1 |
| Exact Mass | 167.073 Da |
| Monoisotopic Mass | 167.073 Da |
| Topological Polar Surface Area | 23.800 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 212.000 |
| 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 |
