≥97% 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 8 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Canonical Smiles | C1COCCN1C2=CC=CC(=C2)C#N |
|---|---|
| IUPAC Name | 3-morpholin-4-ylbenzonitrile |
| InChIKey | OQRDPCPTEDSJHU-UHFFFAOYSA-N |
| INCHI | 1S/C11H12N2O/c12-9-10-2-1-3-11(8-10)13-4-6-14-7-5-13/h1-3,8H,4-7H2 |
| Isomeric SMILES | C1COCCN1C2=CC=CC(=C2)C#N |
| Molecular Weight | 188.23 |
| Reaxy-Rn | 8201838 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8201838&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 | Organoheterocyclic compounds |
| Class | Oxazinanes |
| Subclass | Morpholines |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Phenylmorpholines |
| Alternative Parents | Dialkylarylamines Benzonitriles Aniline and substituted anilines Oxacyclic compounds Nitriles Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteromonocyclic compounds |
| Substituents | Phenylmorpholine - Benzonitrile - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - Monocyclic benzene moiety - Benzenoid - Tertiary amine - Dialkyl ether - Ether - Carbonitrile - Nitrile - Oxacycle - Azacycle - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Cyanide - Hydrocarbon derivative - Amine - Aromatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as phenylmorpholines. These are aromatic compounds containing a morpholine ring and a benzene ring linked to each other through a CC or a CN bond. |
| 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 |
|---|---|---|---|
 D2614270 | Certificate of Analysis | Jan 09, 2026 | M352915 |
| D2614271 | Certificate of Analysis | Jan 09, 2026 | M352915 |
| D2623737 | Certificate of Analysis | Jan 09, 2026 | M352915 |
| D2623739 | Certificate of Analysis | Jan 09, 2026 | M352915 |
| Sensitivity | Moisture sensitive |
|---|---|
| Molecular Weight | 188.230 g/mol |
| XLogP3 | 1.100 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 188.095 Da |
| Monoisotopic Mass | 188.095 Da |
| Topological Polar Surface Area | 36.300 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 227.000 |
| 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 |
| 1. Qing Zhang, Huiyuan Liu, Junxia Guan, Xiaochun Yang, Baojing Luo. (2022) Synergistic Flame Retardancy of Phosphatized Sesbania Gum/Ammonium Polyphosphate on Polylactic Acid. MOLECULES, 27 (15): (4748). [PMID:35897921] [10.3390/molecules27154748] |
| 2. Xin Jia, Chang-Ling Yin, Jing Li, Juan-Rong Li, Bao-Li An, Jiaqiang Xu. (2022) Efficient Synthesis of Yellow-Green Carbon Quantum Dots as a Sensitive Fluorescent Probe of Folic Acid. Chemistry-An Asian Journal, 17 (8): (e202200046). [PMID:35233966] [10.1002/asia.202200046] |
| 3. Yu Xie, Qiang Chen, Guoming Huang, Yujun Wang, Weiguo Hu, Zhengren Yan, Xin Wang, Juan Huang, Mingtang Gao, Weiyang Fei, Guangsheng Luo. (2021) Scaling up microreactors for kilogram-scale synthesis of piperacillin: Experiments and computational fluid dynamics simulations. AICHE JOURNAL, 67 (6): (e17231). [PMID:] [10.1002/aic.17231] |
| 4. Yuting Cai, Ye Li, Le Wang, Rong-Jun Xie. (2019) A Facile Synthesis of Water-Resistant CsPbBr3 Perovskite Quantum Dots Loaded Poly(methyl methacrylate) Composite Microspheres Based on In Situ Polymerization. Advanced Optical Materials, 7 (22): (1901075). [PMID:] [10.1002/adom.201901075] |
| 5. Yanyan Cui, Yonglong Chen, Dehua Lei, Junlai Yang, Yan Yang, Jiahui Su. (2019) Facile method to prepared photoinitiated cationic curable plant oil and its enhancement on the impact strength of cycloaliphatic diepoxide. INDUSTRIAL CROPS AND PRODUCTS, [PMID:] [10.1016/j.indcrop.2019.04.028] |
| 6. Yan Liang, Jiawei Tan, Jiexin Wang, Jianfeng Chen, Baochang Sun, Lei Shao. (2014) Erythorbic acid promoted formation of CdS QDs in a tube-in-tube micro-channel reactor. MATERIALS RESEARCH BULLETIN, [PMID:] [10.1016/j.materresbull.2014.09.029] |
| 7. Yan Liang, Kui Yu, Jiexin Wang, Jianfeng Chen, Baochang Sun, Lei Shao. (2014) Erythorbic acid promoted synthesis of CdS quantum dots in aqueous solution and study on optical properties. COLLOIDS AND SURFACES A-PHYSICOCHEMICAL AND ENGINEERING ASPECTS, [PMID:] [10.1016/j.colsurfa.2014.04.049] |
| 8. Song Zhao, Zhi Wang, Xin Wei, Boran Zhao, Jixiao Wang, Shangbao Yang, Shichang Wang. (2012) Performance Improvement of Polysulfone Ultrafiltration Membrane Using Well-Dispersed Polyaniline–Poly(vinylpyrrolidone) Nanocomposite as the Additive. INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH, [PMID:] [10.1021/ie202503p] |
