N-[3-(diethylamino)propyl]-4-[[1,3-dioxo-1-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]butan-2-yl]diazenyl]benzamide
C25H31N7O4
Consulting for N-[3-(diethylamino)propyl]-4-[[1,3-dioxo-1-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]butan-2-yl]diazenyl]benzamide
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Identification
- CAS Number
- 164578-14-7
- EC Number
- 404-910-2
- UN Number
- 3077
- Index Number
- 611-017-00-3
- PubChem CID
- 57490352
Physical-chemical properties
- Molecular Formula
- C25H31N7O4
- Molar Mass
- 493.60 g/mol
- IUPAC Name
- N-[3-(diethylamino)propyl]-4-[[1,3-dioxo-1-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]butan-2-yl]diazenyl]benzamide
Chemical Identifiers
- InChI
- InChI=1S/C25H31N7O4/c1-4-32(5-2)14-6-13-26-23(34)17-7-9-18(10-8-17)30-31-22(16(3)33)24(35)27-19-11-12-20-21(15-19)29-25(36)28-20/h7-12,15,22H,4-6,13-14H2,1-3H3,(H,26,34)(H,27,35)(H2,28,29,36)
- InChI Key
- CLMHFPYRSACVJX-UHFFFAOYSA-N
Overview
N-[3-(diethylamino)propyl]-4-[[1,3-dioxo-1-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]butan-2-yl]diazenyl]benzamide (CAS 164578-14-7) is a complex organic compound featuring diazene linkage and benzimidazole functionality with specialized industrial applications. This sophisticated chemical compound, with molecular formula C25H31N7O4 and molecular weight of 493.6 g/mol, belongs to the family of substituted benzamides containing both diazene and benzimidazole structural elements. The molecule incorporates a diethylamino propyl side chain, providing unique chemical properties that distinguish it from simpler benzamide derivatives like 2,4-dihydroxy-N-(2-methoxyphenyl)benzamide, which lacks the complex diazene-benzimidazole framework. The compound is classified under European regulations with EC number 404-910-2 and carries specific hazard classifications including Skin Sensitization Category 1 and Aquatic Chronic Toxicity Category 2. Safety handling requires appropriate precautions due to its sensitizing properties, indicated by GHS07 and GHS09 pictograms with a "Warning" signal word. Transportation falls under ADR Class 9 for miscellaneous dangerous goods. Primary industrial applications include use as a specialized intermediate in pharmaceutical synthesis, particularly in the development of compounds requiring benzimidazole functionality. The compound also serves as a research chemical for materials science applications and as a building block in the synthesis of complex organic molecules. Its unique structural features make it valuable in developing compounds with specific biological or chemical activities. Unlike simpler aniline derivatives such as 2-phenylsulfanylaniline, this compound's complex architecture enables highly specialized applications in advanced chemical synthesis. OYSI maintains reliable supply chains for this technical-grade chemical compound, ensuring consistent availability for European industrial customers requiring high-quality specialty chemicals.
Safety & Classification
Skin Sens. 1; Aquatic Chronic 2
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
Skin Contact
Measures if substance contacts the skin
First Aid Actions
- +P302IF ON SKIN:
- +P352Wash with plenty of water.
- +P361Take off immediately all contaminated clothing.
- +P313Get medical advice/attention.
Related hazard statements:
General Measures
Emergency 112 | Poison Control: +49 30 19240 (DE), +33 1 45 42 59 59 (FR), +31 30 274 88 88 (NL)
First aid measures are based on CLP classification and associated P-statements. They do not replace the Safety Data Sheet (SDS). In case of emergency, always consult the full SDS and a physician.
Transport (ADR)
| UN Number | 3077 |
| ADR Class | 9 |
| Packing Group | III |
| Tunnel Code | - |
| Proper Shipping Name | 2-(4-(Diethylaminopropylcarbamoyl)phenylazo)-3-oxo-N-(2,3-dihydro-2-oxobenzimidazol-5-yl)butyramid |
| Marine Pollutant | No |
Frequently Asked Questions
What is N-[3-(diethylamino)propyl]-4-[[1,3-dioxo-1-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]butan-2-yl]diazenyl]benzamide?
N-[3-(diethylamino)propyl]-4-[[1,3-dioxo-1-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]butan-2-yl]diazenyl]benzamide is a complex organic compound with CAS number 164578-14-7 and molecular formula C25H31N7O4. This synthetic chemical has a molecular weight of 493.6 g/mol and features multiple functional groups including diethylamino, benzamide, and benzimidazole moieties. The compound is classified as a skin sensitizer and poses chronic aquatic toxicity risks.
What are the physicochemical properties of N-[3-(diethylamino)propyl]-4-[[1,3-dioxo-1-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]butan-2-yl]diazenyl]benzamide?
This compound exhibits properties typical of complex organic molecules with its molecular weight of 493.6 g/mol and formula C25H31N7O4. The presence of multiple nitrogen atoms, carbonyl groups, and aromatic rings suggests moderate polarity. The diethylamino group indicates basic properties, while the benzimidazole and benzamide structures contribute to the compound's stability. Specific physical properties such as melting point, boiling point, and exact solubility data require experimental determination due to the molecule's structural complexity.
What is N-[3-(diethylamino)propyl]-4-[[1,3-dioxo-1-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]butan-2-yl]diazenyl]benzamide used for?
This compound serves specialized applications in chemical research and industrial processes due to its complex molecular structure containing benzimidazole and azo functional groups. The benzimidazole moiety suggests potential pharmaceutical or agrochemical applications, while the azo linkage indicates possible use in dye chemistry or as an intermediate in organic synthesis. The diethylamino propyl chain may facilitate specific interactions in biological or materials science applications, though exact uses depend on the specific industrial requirements.
How to safely handle N-[3-(diethylamino)propyl]-4-[[1,3-dioxo-1-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]butan-2-yl]diazenyl]benzamide?
Safe handling requires strict skin contact prevention due to the compound's Skin Sens. 1 classification as a skin sensitizer. Wear chemical-resistant gloves, protective clothing, and safety glasses at minimum. Ensure adequate ventilation in work areas and avoid generating dust or aerosols. The GHS07 pictogram indicates health hazards requiring careful exposure control. Wash hands thoroughly after handling and avoid eating, drinking, or smoking in work areas. Train personnel on sensitization risks and emergency procedures.
How should N-[3-(diethylamino)propyl]-4-[[1,3-dioxo-1-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]butan-2-yl]diazenyl]benzamide be stored?
Proper storage requires cool, dry conditions away from incompatible materials and heat sources. Store in tightly sealed, properly labeled containers in a well-ventilated area with controlled access. Due to the Aquatic Chronic 2 classification, prevent environmental release through secondary containment measures. Keep away from strong oxidizing agents and maintain temperature stability to prevent degradation. Implement inventory management to ensure proper rotation and monitor container integrity regularly to prevent leaks or contamination.
What to do in case of contact with N-[3-(diethylamino)propyl]-4-[[1,3-dioxo-1-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]butan-2-yl]diazenyl]benzamide?
Immediate skin contact requires thorough washing with soap and water for at least 15 minutes, removing contaminated clothing. Due to the skin sensitization potential, monitor for allergic reactions and seek medical attention if irritation develops. For eye contact, flush immediately with clean water for 15 minutes and obtain medical evaluation. If inhaled, move to fresh air immediately. For ingestion, do not induce vomiting and seek immediate medical attention. Always inform medical personnel of the specific chemical name and CAS number 164578-14-7.
How to properly dispose of N-[3-(diethylamino)propyl]-4-[[1,3-dioxo-1-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]butan-2-yl]diazenyl]benzamide?
Disposal must comply with local, national, and EU waste regulations as hazardous chemical waste. The compound cannot be disposed of in regular waste streams due to its classification as a skin sensitizer and aquatic chronic toxin. Contact licensed waste disposal companies specializing in chemical waste treatment. Prevent environmental release during disposal processes and maintain proper documentation for regulatory compliance. Small quantities may require incineration at approved facilities, while larger amounts need specialized treatment protocols.
How to transport N-[3-(diethylamino)propyl]-4-[[1,3-dioxo-1-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]butan-2-yl]diazenyl]benzamide?
Transport classification falls under ADR Class 9 (Miscellaneous dangerous goods), Packing Group III, indicating moderate danger level during transport. Use appropriate packaging meeting UN specifications for Class 9 materials and ensure proper labeling with GHS07 and GHS09 pictograms. Transport documentation must include the correct chemical name, CAS number, and hazard classifications. Vehicles require proper placarding and drivers need dangerous goods training. Avoid temperature extremes during transport and implement spill prevention measures.
Is N-[3-(diethylamino)propyl]-4-[[1,3-dioxo-1-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]butan-2-yl]diazenyl]benzamide subject to special regulations?
This compound is subject to EU REACH regulation requiring registration for manufacture or import above one tonne annually. CLP regulation mandates classification as Skin Sens. 1 and Aquatic Chronic 2 with appropriate labeling including Warning signal word and GHS07/GHS09 pictograms. The compound is not currently listed as a Substance of Very High Concern (SVHC). National chemical inventories may require notification, and workplace exposure limits may apply under occupational health regulations in different EU member states.
Where to buy N-[3-(diethylamino)propyl]-4-[[1,3-dioxo-1-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]butan-2-yl]diazenyl]benzamide in Europe?
OYSI serves as a reliable European distributor for this specialized chemical compound, providing access to high-quality materials with proper documentation and regulatory compliance. As an established chemical distributor, OYSI can supply the compound with appropriate safety data sheets, certificates of analysis, and transport documentation meeting EU requirements. Contact OYSI directly for availability, specifications, and delivery options across European markets. Their expertise ensures proper handling of the regulatory requirements associated with this skin-sensitizing compound.
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SDS Service
Request Safety Data Sheet for N-[3-(diethylamino)propyl]-4-[[1,3-dioxo-1-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]butan-2-yl]diazenyl]benzamide
Technical Consulting
Application advice for N-[3-(diethylamino)propyl]-4-[[1,3-dioxo-1-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]butan-2-yl]diazenyl]benzamide
REACH Safety Data Sheet
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Digital Product Passport
EU-compliant product documentation
ADR Consulting for N-[3-(diethylamino)propyl]-4-[[1,3-dioxo-1-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]butan-2-yl]diazenyl]benzamide
N-[3-(diethylamino)propyl]-4-[[1,3-dioxo-1-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]butan-2-yl]diazenyl]benzamide 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.