Butyl(triphenyl)boranuide;diethyl-[4-[(2E)-1,5,5-tris[4-(diethylamino)phenyl]penta-2,4-dienylidene]cyclohexa-2,5-dien-1-ylidene]azanium
C67H83BN4
butyl(triphenyl)boranuide;diethyl-[4-[(2E)-1,5,5-tris[4-(diethylamino)phenyl]penta-2,4-dienylidene]cyclohexa-2,5-dien-1-ylidene]azanium
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Identification
- CAS Number
- 141714-54-7
- EC Number
- 418-070-1
- UN Number
- 3077
- Index Number
- 005-012-00-X
- PubChem CID
- 87834900
Physical-chemical properties
- Molecular Formula
- C67H83BN4
- Molar Mass
- 955.20 g/mol
- IUPAC Name
- butyl(triphenyl)boranuide;diethyl-[4-[(2E)-1,5,5-tris[4-(diethylamino)phenyl]penta-2,4-dienylidene]cyclohexa-2,5-dien-1-ylidene]azanium
Chemical Identifiers
- InChI
- InChI=1S/C45H59N4.C22H24B/c1-9-46(10-2)40-28-20-36(21-29-40)44(37-22-30-41(31-23-37)47(11-3)12-4)18-17-19-45(38-24-32-42(33-25-38)48(13-5)14-6)39-26-34-43(35-27-39)49(15-7)16-8;1-2-3-19-23(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22/h17-35H,9-16H2,1-8H3;4-18H,2-3,19H2,1H3/q+1;-1
- InChI Key
- NJXDGWMULJMJKU-UHFFFAOYSA-N
Overview
Butyl(triphenyl)boranuide;diethyl-[4-[(2E)-1,5,5-tris[4-(diethylamino)phenyl]penta-2,4-dienylidene]cyclohexa-2,5-dien-1-ylidene]azanium (CAS 141714-54-7) is a complex organoborane compound with distinctive photochemical and optical properties. This sophisticated chemical compound represents an advanced organoborane structure characterized by its substantial molecular weight of 955.2 g/mol and complex formula C67H83BN4. The molecule combines a butyl(triphenyl)boranuide anion with an elaborate cationic chromophore system featuring multiple diethylamino-substituted phenyl groups connected through a conjugated polyene chain. This unique molecular architecture confers distinctive optical and electronic properties that make it valuable for specialized industrial applications. The compound exhibits specific safety considerations, classified under GHS pictograms GHS07 and GHS09 with a "Warning" signal word. Primary hazards include skin sensitization (Skin Sens. 1) and significant aquatic toxicity (Aquatic Acute 1; Aquatic Chronic 1), requiring appropriate handling protocols and environmental protection measures. Transportation falls under ADR Class 9, indicating miscellaneous dangerous goods classification. Like other complex organoborane compounds such as butyl(triphenyl)boranuide;tetrabutylazanium, careful storage and handling procedures are essential to maintain product integrity and workplace safety. Industrial applications typically focus on advanced optical systems, specialty dyes, and electronic materials where the compound's unique photochemical properties provide specific performance advantages. The extensive conjugated system and borane functionality make it particularly suitable for applications requiring precise optical response characteristics or specialized electronic properties. OYSI maintains reliable supply chains for this specialized chemical compound, ensuring consistent availability for European industrial customers requiring high-quality organoborane materials for their technical applications.
Safety & Classification
Skin Sens. 1; 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
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 | Diethyl{4-[1,5,5-tris(4-diethylaminophenyl)penta-2,4-dienyliden]cyclohexa-2,5-dienyliden}ammonium butyltriphenylborat(1-) |
| Marine Pollutant | No |
Frequently Asked Questions
What is butyl(triphenyl)boranuide;diethyl-[4-[(2E)-1,5,5-tris[4-(diethylamino)phenyl]penta-2,4-dienylidene]cyclohexa-2,5-dien-1-ylidene]azanium?
Butyl(triphenyl)boranuide;diethyl-[4-[(2E)-1,5,5-tris[4-(diethylamino)phenyl]penta-2,4-dienylidene]cyclohexa-2,5-dien-1-ylidene]azanium is a complex organic chemical compound with CAS number 141714-54-7. This compound has a molecular formula of C67H83BN4 and a molecular weight of 955.2 g/mol. It belongs to the boron-containing organic compounds family and features multiple phenyl groups and diethylamino substituents in its structure, making it a highly specialized chemical for industrial applications.
What are the physicochemical properties of butyl(triphenyl)boranuide;diethyl-[4-[(2E)-1,5,5-tris[4-(diethylamino)phenyl]penta-2,4-dienylidene]cyclohexa-2,5-dien-1-ylidene]azanium?
This compound is characterized by its high molecular weight of 955.2 g/mol and complex molecular structure containing boron, nitrogen, and multiple aromatic rings. The presence of numerous diethylamino groups and phenyl substituents suggests limited water solubility but good solubility in organic solvents. The compound's large molecular size and multiple functional groups indicate it likely exists as a solid at room temperature with specific optical properties due to its extended conjugated system.
What is butyl(triphenyl)boranuide;diethyl-[4-[(2E)-1,5,5-tris[4-(diethylamino)phenyl]penta-2,4-dienylidene]cyclohexa-2,5-dien-1-ylidene]azanium used for?
This compound is primarily used as a specialized chemical reagent in advanced organic synthesis and materials science applications. Its complex structure containing boron and extended conjugated systems makes it valuable for research and development in pharmaceutical intermediates, advanced materials, and specialty chemical manufacturing. The compound may also find applications in analytical chemistry as a reagent or standard, particularly in industries requiring high-purity specialty chemicals.
How to handle butyl(triphenyl)boranuide;diethyl-[4-[(2E)-1,5,5-tris[4-(diethylamino)phenyl]penta-2,4-dienylidene]cyclohexa-2,5-dien-1-ylidene]azanium safely?
Safe handling requires appropriate personal protective equipment including nitrile gloves, safety goggles, and protective clothing due to its Skin Sens. 1 classification. Work in well-ventilated areas or under fume hoods to minimize exposure. Avoid direct skin contact and inhalation. Use proper laboratory techniques including secondary containment and spill control measures. Ensure emergency eyewash and safety shower facilities are readily accessible when handling this sensitizing compound.
How to store butyl(triphenyl)boranuide;diethyl-[4-[(2E)-1,5,5-tris[4-(diethylamino)phenyl]penta-2,4-dienylidene]cyclohexa-2,5-dien-1-ylidene]azanium correctly?
Store this compound in a cool, dry, well-ventilated area away from incompatible materials and ignition sources. Keep containers tightly sealed in original packaging to prevent contamination and degradation. Due to its complex organic structure, protect from direct sunlight and extreme temperatures. Store separately from oxidizing agents and water-reactive materials. Implement proper inventory management and ensure storage areas comply with local chemical storage regulations.
What to do in case of contact with butyl(triphenyl)boranuide;diethyl-[4-[(2E)-1,5,5-tris[4-(diethylamino)phenyl]penta-2,4-dienylidene]cyclohexa-2,5-dien-1-ylidene]azanium?
Immediate skin contact requires thorough washing with soap and water for at least 15 minutes, removing contaminated clothing. For eye contact, flush immediately with clean water for 15-20 minutes while holding eyelids open. If inhaled, move to fresh air immediately. Due to the Skin Sens. 1 classification, seek medical attention if irritation develops or persists. Do not induce vomiting if swallowed; rinse mouth and seek immediate medical advice while showing the safety data sheet.
How to dispose of butyl(triphenyl)boranuide;diethyl-[4-[(2E)-1,5,5-tris[4-(diethylamino)phenyl]penta-2,4-dienylidene]cyclohexa-2,5-dien-1-ylidene]azanium properly?
Disposal must be conducted through licensed hazardous waste contractors in accordance with local, national, and EU waste regulations. The compound cannot be disposed of via regular waste streams due to its environmental hazard classifications (Aquatic Acute 1; Aquatic Chronic 1). Containerize waste properly, ensuring compatibility with packaging materials. Maintain detailed waste manifests and tracking documentation. Consider waste minimization strategies including recovery or recycling through specialized chemical waste management companies.
How to transport butyl(triphenyl)boranuide;diethyl-[4-[(2E)-1,5,5-tris[4-(diethylamino)phenyl]penta-2,4-dienylidene]cyclohexa-2,5-dien-1-ylidene]azanium?
This compound is classified as ADR Class 9 (Miscellaneous Dangerous Substances), Packing Group III for transport purposes. Use appropriate packaging meeting UN specification requirements for Class 9 materials. Ensure proper labeling with hazard diamonds and shipping documentation including dangerous goods declarations. Transport vehicles must comply with ADR regulations including driver certification and emergency equipment requirements. Coordinate with experienced dangerous goods logistics providers for safe transportation.
Is butyl(triphenyl)boranuide;diethyl-[4-[(2E)-1,5,5-tris[4-(diethylamino)phenyl]penta-2,4-dienylidene]cyclohexa-2,5-dien-1-ylidene]azanium subject to specific regulations?
This compound is subject to EU REACH regulation requiring registration for import/manufacture above tonnage thresholds. CLP regulation applies for classification and labeling as Skin Sens. 1, Aquatic Acute 1, and Aquatic Chronic 1. It is not currently listed as a Substance of Very High Concern (SVHC). Additional regulations may include national chemical inventory requirements, workplace exposure limits, and environmental discharge restrictions depending on use and jurisdiction.
Where to buy butyl(triphenyl)boranuide;diethyl-[4-[(2E)-1,5,5-tris[4-(diethylamino)phenyl]penta-2,4-dienylidene]cyclohexa-2,5-dien-1-ylidene]azanium in Europe?
OYSI serves as a reliable European distributor for this specialized compound, offering professional chemical distribution services across European markets. Our experienced team provides technical support, regulatory compliance assistance, and proper handling guidance. We maintain appropriate storage facilities and transportation capabilities for hazardous materials. Contact OYSI directly for availability, specifications, and delivery options tailored to your specific requirements and applications in research or industrial settings.
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Butyl(triphenyl)boranuide;diethyl-[4-[(2E)-1,5,5-tris[4-(diethylamino)phenyl]penta-2,4-dienylidene]cyclohexa-2,5-dien-1-ylidene]azanium 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.