≥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.
Octylbenzene (1-Phenyloctane) forms charge-transfer complexes with fluoranil and 1,3,5-trinitrobenzene.
| Pubchem Sid | 504752761 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504752761 |
| Canonical Smiles | CCCCCCCCC1=CC=CC=C1 |
| IUPAC Name | octylbenzene |
| InChIKey | CDKDZKXSXLNROY-UHFFFAOYSA-N |
| INCHI | 1S/C14H22/c1-2-3-4-5-6-8-11-14-12-9-7-10-13-14/h7,9-10,12-13H,2-6,8,11H2,1H3 |
| Isomeric SMILES | CCCCCCCCC1=CC=CC=C1 |
| WGK Germany | 3 |
| Molecular Weight | 190.33 |
| Reaxy-Rn | 1906253 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1906253&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 | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Benzene and substituted derivatives |
| Alternative Parents | Aromatic hydrocarbons Unsaturated hydrocarbons |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Monocyclic benzene moiety - Aromatic hydrocarbon - Unsaturated hydrocarbon - Hydrocarbon - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene. |
| 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 |
|---|---|---|---|
 B2225702 | Certificate of Analysis | Dec 12, 2025 | N159325 |
| B2225714 | Certificate of Analysis | Dec 12, 2025 | N159325 |
| B2225723 | Certificate of Analysis | Dec 12, 2025 | N159325 |
| B2225726 | Certificate of Analysis | Dec 12, 2025 | N159325 |
| A2211112 | Certificate of Analysis | Oct 13, 2025 | N159325 |
| B2521474 | Certificate of Analysis | Jun 18, 2024 | N159325 |
| B2521492 | Certificate of Analysis | Jun 18, 2024 | N159325 |
| G1925063 | Certificate of Analysis | May 15, 2023 | N159325 |
| E2424028 | Certificate of Analysis | Jan 05, 2022 | N159325 |
| I2505064 | Certificate of Analysis | Jan 05, 2022 | N159325 |
| Solubility | Immiscible with water. |
|---|---|
| Refractive Index | 1.48 |
| Flash Point(°F) | 224.6 °F |
| Flash Point(°C) | 107°C |
| Boil Point(°C) | 264°C |
| Melt Point(°C) | -36°C |
| Molecular Weight | 190.320 g/mol |
| XLogP3 | 6.600 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 0 |
| Rotatable Bond Count | 7 |
| Exact Mass | 190.172 Da |
| Monoisotopic Mass | 190.172 Da |
| Topological Polar Surface Area | 0.000 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 111.000 |
| 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 |
