3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one
C21H22ClNO4
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Identification
- CAS Number
- 110488-70-5
- EC Number
- 404-200-2
- UN Number
- 3077
- Index Number
- 613-102-00-0
- PubChem CID
- 86298
Physical-chemical properties
- Molecular Formula
- C21H22ClNO4
- Molar Mass
- 387.90 g/mol
- IUPAC Name
- 3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one
Chemical Identifiers
- InChI
- InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3
- InChI Key
- QNBTYORWCCMPQP-UHFFFAOYSA-N
Overview
3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one (CAS 110488-70-5) is an organic chemical compound featuring chlorinated phenyl groups and morpholine functionality with reproductive toxicity properties. This complex organic molecule belongs to the class of substituted enones, characterized by its distinctive structural features including a 4-chlorophenyl group, a 3,4-dimethoxyphenyl moiety, and a morpholine ring system. With a molecular formula of C21H22ClNO4 and molecular weight of 387.9 g/mol, this compound exhibits specific chemical properties that make it valuable for various industrial applications. The presence of both electron-withdrawing chlorine and electron-donating methoxy groups creates an interesting electronic distribution across the molecule. From a safety perspective, this substance is classified under the CLP Regulation with significant hazard classifications including Reproductive Toxicity Category 1B and Aquatic Chronic Toxicity Category 2. The assigned danger signal word and corresponding GHS08 and GHS09 pictograms indicate serious health hazards and environmental concerns. Transport regulations classify it under ADR Class 9 as a miscellaneous dangerous substance, requiring appropriate handling protocols and safety measures during storage and transportation. The compound finds applications primarily in pharmaceutical intermediate synthesis, specialty chemical manufacturing, and research applications where its unique structural framework serves as a building block for more complex molecules. Unlike simpler aromatic compounds such as 4-[[4-(dimethylamino)phenyl]methyl]-N,N-dimethylaniline, this morpholine-containing structure offers enhanced solubility and reactivity characteristics. Its applications may also extend to materials science research and specialized organic synthesis processes. OYSI maintains reliable access to this specialized chemical compound, ensuring consistent supply for European industrial and research customers requiring high-quality technical grade materials.
Safety & Classification
Repr. 1B; Aquatic Chronic 2
GHS Pictograms
HHazard Statements (H-Statements)
Describe the nature and severity of the hazard
Toxic to aquatic life with long lasting effects.
Classification according to CLP Regulation (EC) No 1272/2008. The complete list of hazard and precautionary statements can be found in the Safety Data Sheet (SDS).
First Aid Measures
Transport (ADR)
| UN Number | 3077 |
| ADR Class | 9 |
| Packing Group | III |
| Tunnel Code | - |
| Proper Shipping Name | Dimethomorph (ISO) |
| Marine Pollutant | No |
Frequently Asked Questions
What is 3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one?
3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one is an organic chemical compound with the molecular formula C21H22ClNO4 and CAS number 110488-70-5. This synthetic molecule has a molecular weight of 387.9 g/mol and contains chlorophenyl, dimethoxyphenyl, and morpholine functional groups. It is classified as a reproductive toxicant category 1B and presents chronic aquatic toxicity, requiring careful handling and specialized safety measures.
What are the physicochemical properties of 3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one?
3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one is a complex organic compound with a molecular weight of 387.9 g/mol. The molecule contains multiple aromatic rings with chloro and methoxy substituents, along with a morpholine group. Its physicochemical properties are influenced by these functional groups, providing specific solubility characteristics and stability profiles that must be considered during handling and storage operations.
What is 3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one used for?
3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one is primarily used in specialized chemical research and pharmaceutical intermediary applications. Its complex molecular structure makes it valuable for synthetic chemistry processes and potentially as a building block for more complex pharmaceutical compounds. Due to its reproductive toxicity classification, its use is restricted to professional and industrial applications with appropriate safety controls and regulatory compliance.
How to safely handle 3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one?
Safe handling requires comprehensive personal protective equipment due to its Repr. 1B classification. Operators must wear protective gloves, safety goggles, and respiratory protection in well-ventilated areas or under fume hoods. Direct skin contact and inhalation must be avoided at all costs. Work areas should be equipped with emergency eyewash stations and safety showers. Only trained personnel should handle this substance, following strict protocols to prevent reproductive health hazards.
How to properly store 3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one?
Proper storage requires secure, temperature-controlled environments away from incompatible materials and ignition sources. Containers must be tightly sealed and properly labeled with GHS08 and GHS09 pictograms. Storage areas should be restricted to authorized personnel only, with appropriate ventilation and spill containment measures. The storage location must comply with local regulations for reproductive toxicants and be separated from food, beverages, and areas accessible to pregnant workers.
What to do in case of contact with 3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one?
Immediate decontamination is critical due to reproductive toxicity risks. For skin contact, remove contaminated clothing and wash affected areas thoroughly with soap and water for at least 15 minutes. In case of eye contact, rinse immediately with clean water for 15 minutes while holding eyelids open. If inhaled, move to fresh air immediately. Seek medical attention promptly in all cases, bringing the safety data sheet. Do not induce vomiting if ingested.
How to properly dispose of 3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one?
Disposal must comply with hazardous waste regulations due to its reproductive toxicity and aquatic chronic toxicity classification. The substance cannot be disposed of in regular waste streams or sewage systems. Authorized hazardous waste disposal companies must handle collection and treatment. Containers should be properly labeled and sealed before collection. Documentation must be maintained according to waste tracking requirements, and disposal methods must prevent environmental contamination.
How to transport 3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one?
Transportation follows ADR Class 9 regulations as Group III miscellaneous dangerous goods. Packages must bear appropriate UN markings, proper shipping names, and hazard labels including GHS08 and GHS09 pictograms. Vehicles require placarding and drivers need ADR training certificates. Transport documentation must include safety data sheets and emergency response information. Special handling procedures apply due to reproductive toxicity classification, requiring secure packaging and authorized transport companies only.
Is 3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one subject to specific regulations?
Yes, this substance falls under multiple regulatory frameworks including REACH registration requirements and CLP classification as Repr. 1B and Aquatic Chronic 2. Although not currently listed as a SVHC, its reproductive toxicity classification subjects it to strict handling and use restrictions. Companies must comply with occupational exposure limits, worker protection measures, and environmental discharge controls. Authorization may be required for certain uses under REACH Article 56.
Where to buy 3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one in Europe?
OYSI serves as a specialized European distributor for 3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one, providing compliant supply chains for industrial and research applications. As an established chemical distributor, OYSI ensures proper documentation, safety data sheets, and regulatory compliance for European customers. Due to the substance's reproductive toxicity classification, purchases are restricted to qualified professional users with appropriate handling capabilities and safety infrastructure.
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3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one is a dangerous good. We support you with labeling, packaging, and transport documentation.
Data Sources
Classification per CLP Regulation (EC) No 1272/2008. Data from ECHA and PubChem.