1-N,1-N,3-N,3-N-tetracyclohexylbenzene-1,3-dicarboxamide
C32H48N2O2
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Identification
- CAS Number
- 104560-40-9
- EC Number
- 431-040-0
- UN Number
- 3077
- Index Number
- 616-155-00-8
- PubChem CID
- 4152020
Physical-chemical properties
- Molecular Formula
- C32H48N2O2
- Molar Mass
- 492.70 g/mol
- IUPAC Name
- 1-N,1-N,3-N,3-N-tetracyclohexylbenzene-1,3-dicarboxamide
Chemical Identifiers
- InChI
- InChI=1S/C32H48N2O2/c35-31(33(27-16-5-1-6-17-27)28-18-7-2-8-19-28)25-14-13-15-26(24-25)32(36)34(29-20-9-3-10-21-29)30-22-11-4-12-23-30/h13-15,24,27-30H,1-12,16-23H2
- InChI Key
- IVODSFSWEHIWMB-UHFFFAOYSA-N
Overview
1-N,1-N,3-N,3-N-tetracyclohexylbenzene-1,3-dicarboxamide (CAS 104560-40-9) is an organic dicarboxamide compound with aquatic toxicity properties and industrial chemical applications. This specialized organic compound represents a sophisticated dicarboxamide derivative featuring a benzene ring core substituted with two carboxamide groups at positions 1 and 3, each bearing two cyclohexyl substituents. With its molecular formula C32H48N2O2 and molecular weight of 492.7 g/mol, this substance exhibits significant structural complexity that contributes to its unique chemical and physical properties. The compound is classified under EC number 431-040-0 and falls within the broader category of aromatic amide derivatives used in various technical applications. From a safety perspective, 1-N,1-N,3-N,3-N-tetracyclohexylbenzene-1,3-dicarboxamide is classified as Aquatic Acute 1 and Aquatic Chronic 1, indicating significant environmental concerns regarding aquatic ecosystems. The substance carries a Warning signal word and displays the GHS09 pictogram, emphasizing its environmental hazard classification. Transportation falls under ADR Class 9, designating it as a miscellaneous dangerous substance requiring appropriate handling protocols. The compound finds applications in specialized chemical synthesis, particularly as an intermediate in the production of advanced materials and specialty chemicals. Its structural similarity to other complex organic molecules, such as N-benzyl-2-[4-fluoro-3-(trifluoromethyl)phenoxy]butanamide, makes it valuable in pharmaceutical and agrochemical research applications. Additionally, it serves as a building block in polymer chemistry and materials science applications. OYSI maintains reliable supply chains for this technical-grade compound, ensuring consistent availability for qualified industrial customers requiring this specialized chemical intermediate.
Safety & Classification
Aquatic Acute 1; Aquatic Chronic 1
GHS Pictograms
HHazard Statements (H-Statements)
Describe the nature and severity of the hazard
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 | N,N,N',N'-Tetracyclohexyl-1,3-benzendicarboxamid |
| Marine Pollutant | No |
Frequently Asked Questions
What is 1-N,1-N,3-N,3-N-tetracyclohexylbenzene-1,3-dicarboxamide?
1-N,1-N,3-N,3-N-tetracyclohexylbenzene-1,3-dicarboxamide is an organic chemical compound with the molecular formula C32H48N2O2 and CAS number 104560-40-9. This substance features a benzene ring substituted with two carboxamide groups at positions 1 and 3, each bearing two cyclohexyl groups. With a molecular weight of 492.7 g/mol, it belongs to the class of aromatic dicarboxamides and exhibits significant environmental hazard properties.
What are the physicochemical properties of 1-N,1-N,3-N,3-N-tetracyclohexylbenzene-1,3-dicarboxamide?
1-N,1-N,3-N,3-N-tetracyclohexylbenzene-1,3-dicarboxamide is a solid compound at room temperature with a molecular weight of 492.7 g/mol. Due to its large molecular structure with multiple cyclohexyl groups, it likely exhibits low water solubility but good solubility in organic solvents. The compound's high molecular weight and aromatic-aliphatic structure suggest it has relatively high melting and boiling points, though specific physical constants require analytical determination.
What is 1-N,1-N,3-N,3-N-tetracyclohexylbenzene-1,3-dicarboxamide used for?
1-N,1-N,3-N,3-N-tetracyclohexylbenzene-1,3-dicarboxamide serves as a specialized chemical intermediate in organic synthesis and pharmaceutical research. Its unique molecular structure with multiple cyclohexyl substituents makes it valuable for developing complex organic molecules, particularly in medicinal chemistry applications. The compound may also function as a building block for advanced materials, polymer additives, or specialty chemicals requiring specific structural features and stability characteristics.
How to handle 1-N,1-N,3-N,3-N-tetracyclohexylbenzene-1,3-dicarboxamide safely?
1-N,1-N,3-N,3-N-tetracyclohexylbenzene-1,3-dicarboxamide requires careful handling due to its environmental hazard classification (GHS09 pictogram). Wear appropriate personal protective equipment including safety glasses, gloves, and lab coats. Work in well-ventilated areas or under fume hoods to minimize exposure. Avoid release to the environment as the substance is highly toxic to aquatic life. Follow standard laboratory safety protocols and ensure proper training before handling this material.
How to store 1-N,1-N,3-N,3-N-tetracyclohexylbenzene-1,3-dicarboxamide correctly?
1-N,1-N,3-N,3-N-tetracyclohexylbenzene-1,3-dicarboxamide should be stored in tightly sealed containers in a cool, dry, well-ventilated area away from heat sources and incompatible materials. Keep containers upright and properly labeled with hazard information. Due to its environmental hazards, ensure secondary containment to prevent accidental release. Store away from water sources and drainage systems. Maintain storage areas with appropriate spill cleanup materials and emergency response procedures readily available.
What to do in case of contact with 1-N,1-N,3-N,3-N-tetracyclohexylbenzene-1,3-dicarboxamide?
In case of skin contact with 1-N,1-N,3-N,3-N-tetracyclohexylbenzene-1,3-dicarboxamide, immediately remove contaminated clothing and wash the affected area thoroughly with soap and water. For eye contact, flush immediately with clean water for at least 15 minutes and seek medical attention. If inhaled, move to fresh air and monitor breathing. In case of ingestion, do not induce vomiting and seek immediate medical attention. Always consult the safety data sheet for specific emergency procedures.
How to dispose of 1-N,1-N,3-N,3-N-tetracyclohexylbenzene-1,3-dicarboxamide appropriately?
1-N,1-N,3-N,3-N-tetracyclohexylbenzene-1,3-dicarboxamide must be disposed of as hazardous waste due to its environmental toxicity classification. Contact licensed waste disposal companies specialized in chemical waste management. Never dispose of this substance through regular waste streams or pour down drains due to its aquatic toxicity. Follow local and European waste regulations (Waste Framework Directive) and maintain proper waste documentation. Incineration at authorized high-temperature facilities is typically the preferred disposal method.
How to transport 1-N,1-N,3-N,3-N-tetracyclohexylbenzene-1,3-dicarboxamide?
1-N,1-N,3-N,3-N-tetracyclohexylbenzene-1,3-dicarboxamide is classified as ADR Class 9 (Miscellaneous dangerous substances), Packing Group III for transport purposes. This classification requires appropriate packaging, labeling, and documentation according to ADR regulations. Use UN-approved packaging and display proper hazard labels and placards. Transport vehicles must carry appropriate emergency equipment and documentation. Drivers require ADR training certification for Class 9 substances. Ensure compliance with all applicable transport regulations for safe shipment.
Is 1-N,1-N,3-N,3-N-tetracyclohexylbenzene-1,3-dicarboxamide subject to particular regulations?
1-N,1-N,3-N,3-N-tetracyclohexylbenzene-1,3-dicarboxamide is subject to REACH registration requirements in the European Union and must comply with CLP regulation for classification and labeling. The substance is not currently listed as a Substance of Very High Concern (SVHC). Its environmental hazard classification requires compliance with environmental protection regulations and proper waste management procedures. Users must maintain safety data sheets and follow occupational exposure guidelines established by relevant regulatory authorities.
Where to buy 1-N,1-N,3-N,3-N-tetracyclohexylbenzene-1,3-dicarboxamide in Europe?
1-N,1-N,3-N,3-N-tetracyclohexylbenzene-1,3-dicarboxamide is available through OYSI, a specialized European chemical distributor offering high-quality chemical products to industrial and research customers. OYSI provides comprehensive technical support, proper documentation including safety data sheets, and ensures compliance with European chemical regulations. As a professional chemical supplier, OYSI maintains proper handling, storage, and transportation procedures for hazardous materials, ensuring safe and reliable delivery throughout Europe.
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ADR Consulting for 1-N,1-N,3-N,3-N-tetracyclohexylbenzene-1,3-dicarboxamide
1-N,1-N,3-N,3-N-tetracyclohexylbenzene-1,3-dicarboxamide 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.