(2-tert-butyl-4,6-dinitrophenyl) acetate
C12H14N2O6
Consulting for (2-tert-butyl-4,6-dinitrophenyl) acetate
Our experts support you with application, dosage, and compliance.
Identification
- CAS Number
- 3204-27-1
- EC Number
- 221-706-7
- UN Number
- 2779
- Index Number
- 609-031-00-X
- PubChem CID
- 76666
Physical-chemical properties
- Molecular Formula
- C12H14N2O6
- Molar Mass
- 282.25 g/mol
- IUPAC Name
- (2-tert-butyl-4,6-dinitrophenyl) acetate
Chemical Identifiers
- InChI
- InChI=1S/C12H14N2O6/c1-7(15)20-11-9(12(2,3)4)5-8(13(16)17)6-10(11)14(18)19/h5-6H,1-4H3
- InChI Key
- BMJYKXALMDAIEG-UHFFFAOYSA-N
Overview
(2-tert-butyl-4,6-dinitrophenyl) acetate (CAS 3204-27-1) is a nitroaromatic ester compound with significant toxicological properties and environmental impact concerns. This specialized chemical compound belongs to the family of dinitrophenyl derivatives, characterized by its distinctive molecular structure featuring both nitro groups and an acetate ester functionality. With a molecular formula of C12H14N2O6 and molecular weight of 282.25 g/mol, this substance exhibits unique chemical properties that make it valuable for specific industrial applications while requiring careful handling due to its hazardous nature. The compound is classified under multiple danger categories, including reproductive toxicity (Category 1B), acute toxicity, and aquatic toxicity, necessitating strict safety protocols during storage, handling, and transportation. Its ADR classification as Class 6.1 (toxic substances) reflects the serious health risks associated with exposure, requiring specialized knowledge and equipment for safe manipulation. Safety considerations are paramount when working with this material, as it shares toxicological characteristics with related compounds in the dinitrophenyl family, such as 2-tert-butyl-4,6-dinitrophenol, though the acetate ester modification provides distinct chemical behavior and applications. The presence of both the bulky tert-butyl group and dual nitro substituents contributes to its specific reactivity profile and biological activity. Primary industrial applications include use as an intermediate in organic synthesis, particularly in the production of specialized pharmaceuticals and agrochemicals, as well as in research applications requiring precise molecular modifications. The compound also finds application in analytical chemistry as a derivatizing agent for specific analytical procedures. OYSI maintains stock availability of (2-tert-butyl-4,6-dinitrophenyl) acetate for qualified industrial customers with appropriate handling capabilities and regulatory compliance.
Safety & Classification
Repr. 1B; Acute Tox. 3 *; Acute Tox. 2 *; 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:
Ingestion
Measures if substance is accidentally swallowed
First Aid Actions
- +P301IF SWALLOWED:
- +P330Rinse mouth.
- +P331Do NOT induce vomiting.
- +P310Immediately call a POISON CENTER/doctor.
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 | 2779 |
| ADR Class | 6.1 |
| Packing Group | III |
| Tunnel Code | E |
| Proper Shipping Name | Dinoterbacetat |
| Marine Pollutant | No |
Frequently Asked Questions
What is (2-tert-butyl-4,6-dinitrophenyl) acetate?
(2-tert-butyl-4,6-dinitrophenyl) acetate is an organic chemical compound with the molecular formula C12H14N2O6 and CAS number 3204-27-1. This substance belongs to the family of nitrophenyl acetates and has a molecular weight of 282.25 g/mol. It is classified as a hazardous substance with reproductive toxicity, acute toxicity, and environmental hazard properties, requiring careful handling and storage protocols in industrial applications.
What are the physicochemical properties of (2-tert-butyl-4,6-dinitrophenyl) acetate?
(2-tert-butyl-4,6-dinitrophenyl) acetate is a solid organic compound at room temperature with a molecular weight of 282.25 g/mol. The presence of nitro groups and the tert-butyl substituent influences its physical properties and stability. As a nitrophenyl acetate derivative, it likely exhibits limited water solubility due to its organic nature and molecular structure, though specific solubility data would require detailed technical documentation.
What is (2-tert-butyl-4,6-dinitrophenyl) acetate used for?
(2-tert-butyl-4,6-dinitrophenyl) acetate is primarily used as a chemical intermediate in organic synthesis and research applications. Its structure makes it suitable for various chemical transformations and as a building block in pharmaceutical or agrochemical development. Due to its hazardous classification, including reproductive toxicity and acute toxicity, its use is restricted to professional industrial settings with appropriate safety measures and qualified personnel.
How to handle (2-tert-butyl-4,6-dinitrophenyl) acetate safely?
(2-tert-butyl-4,6-dinitrophenyl) acetate requires strict safety protocols due to its Danger signal word and multiple hazard classifications. Personnel must wear appropriate PPE including chemical-resistant gloves, safety goggles, and protective clothing. Work should be conducted in well-ventilated areas or under fume hoods. Avoid skin and eye contact, inhalation, and ingestion. Implement proper hygiene measures and ensure trained personnel handle this reproductive toxin and acute toxicant.
How to store (2-tert-butyl-4,6-dinitrophenyl) acetate correctly?
(2-tert-butyl-4,6-dinitrophenyl) acetate must be stored in a cool, dry, well-ventilated area away from heat sources and incompatible materials. Keep containers tightly sealed and properly labeled with hazard information. Due to its reproductive toxicity and environmental hazards, storage areas should be restricted to authorized personnel only. Implement secondary containment measures to prevent environmental release and ensure compliance with local chemical storage regulations.
What to do in case of contact with (2-tert-butyl-4,6-dinitrophenyl) acetate?
Immediate action is required upon contact with (2-tert-butyl-4,6-dinitrophenyl) acetate due to its acute toxicity. For skin contact, remove contaminated clothing and rinse thoroughly with water for at least 15 minutes. In case of eye contact, flush immediately with clean water for 15 minutes. If inhaled, move to fresh air immediately. For ingestion, do not induce vomiting and seek medical attention immediately. Always consult emergency services and provide the safety data sheet.
How to dispose of (2-tert-butyl-4,6-dinitrophenyl) acetate appropriately?
(2-tert-butyl-4,6-dinitrophenyl) acetate disposal must comply with local and European waste regulations due to its hazardous classification. This substance cannot be disposed of with regular waste and requires specialized hazardous waste treatment. Contact licensed waste disposal companies familiar with toxic and environmentally hazardous chemicals. Prevent release to sewers, waterways, or soil due to its aquatic toxicity classification. Maintain proper waste documentation and disposal certificates.
How to transport (2-tert-butyl-4,6-dinitrophenyl) acetate?
(2-tert-butyl-4,6-dinitrophenyl) acetate is classified as ADR Class 6.1 (Toxic substances), Packing Group III for transportation purposes. Transportation must comply with ADR regulations including proper packaging, labeling, and documentation. Vehicles must carry appropriate safety equipment and drivers require hazardous materials certification. Shipping documentation must include proper shipping names, hazard labels, and emergency response information. Only authorized carriers experienced with toxic substances should handle transportation.
Is (2-tert-butyl-4,6-dinitrophenyl) acetate subject to specific regulations?
(2-tert-butyl-4,6-dinitrophenyl) acetate is subject to European REACH regulation requiring registration and safety data sheets. CLP regulation mandates proper classification and labeling with GHS pictograms (GHS06, GHS08, GHS09). As a reproductive toxin and acutely toxic substance, it may be subject to additional restrictions on use, supply, and handling. Companies must ensure compliance with occupational exposure limits and environmental protection requirements before use.
Where to buy (2-tert-butyl-4,6-dinitrophenyl) acetate in Europe?
(2-tert-butyl-4,6-dinitrophenyl) acetate is available through OYSI, a European distributor of specialized chemical products. OYSI provides this substance to qualified industrial customers with appropriate handling capabilities and regulatory compliance. Due to its hazardous classification, purchase requires proper documentation of intended use and safety measures. Contact OYSI directly for availability, technical specifications, and regulatory documentation required for this controlled chemical substance.
Services for (2-tert-butyl-4,6-dinitrophenyl) acetate
Order (2-tert-butyl-4,6-dinitrophenyl) acetate
Fast delivery across Europe
SDS Service
Request Safety Data Sheet for (2-tert-butyl-4,6-dinitrophenyl) acetate
Technical Consulting
Application advice for (2-tert-butyl-4,6-dinitrophenyl) acetate
REACH Safety Data Sheet
REACH Compliance Service
Digital Product Passport
EU-compliant product documentation
ADR Consulting for (2-tert-butyl-4,6-dinitrophenyl) acetate
(2-tert-butyl-4,6-dinitrophenyl) acetate 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.