2-tert-butyl-4,6-dinitrophenol

C10H12N2O5

CAS1420-07-1
GHS08 Gefahrensymbol: Gesundheitsgefahr – Gesundheitsgefahr
GHS06 Gefahrensymbol: Giftig – Totenkopf mit Knochen
GHS09 Gefahrensymbol: Umweltgefährlich – Umwelt
Danger

Consulting for 2-tert-butyl-4,6-dinitrophenol

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Identification

CAS Number
1420-07-1
EC Number
215-813-8
UN Number
2779
Index Number
609-030-00-4
PubChem CID
14994

Physical-chemical properties

Molecular Formula
C10H12N2O5
Molar Mass
240.21 g/mol
IUPAC Name
2-tert-butyl-4,6-dinitrophenol

Chemical Identifiers

InChI
InChI=1S/C10H12N2O5/c1-10(2,3)7-4-6(11(14)15)5-8(9(7)13)12(16)17/h4-5,13H,1-3H3
InChI Key
IIPZYDQGBIWLBU-UHFFFAOYSA-N

Overview

2-tert-butyl-4,6-dinitrophenol (CAS 1420-07-1) is a substituted dinitrophenol compound with significant toxicological properties and industrial herbicide applications. This highly specialized chemical compound, also known by its IUPAC designation 2-tert-butyl-4,6-dinitrophenol, represents an important member of the dinitrophenol family used in various industrial applications. With the molecular formula C10H12N2O5 and a molecular weight of 240.21 g/mol, this substance exhibits distinct chemical properties due to its tert-butyl substituent and dual nitro groups positioned on the phenolic ring structure. The compound presents significant safety considerations, classified under multiple hazard categories including reproductive toxicity (Repr. 1B), acute toxicity (Acute Tox. 2 and 3), and environmental hazards (Aquatic Acute 1, Aquatic Chronic 1). These classifications necessitate careful handling protocols and appropriate safety measures during storage, transport, and application. The substance falls under ADR transport class 6.1, reflecting its toxic nature, and requires the display of GHS pictograms GHS06, GHS08, and GHS09 with the signal word "Danger." In industrial applications, 2-tert-butyl-4,6-dinitrophenol serves primarily as a selective herbicide component, particularly effective against broadleaf weeds in agricultural settings. The compound also finds use in specialized chemical synthesis processes and as an intermediate in the production of other dinitrophenol derivatives. Its structural similarity to related compounds such as (2-tert-butyl-4,6-dinitrophenyl) acetate makes it valuable in comparative research and development applications within the agrochemical industry. As a trusted European distributor of technical chemicals, OYSI maintains availability of 2-tert-butyl-4,6-dinitrophenol for qualified industrial customers requiring this specialized compound for legitimate commercial applications.

Safety & Classification

Danger
Classification:

Repr. 1B; Acute Tox. 3 *; Acute Tox. 2 *; Aquatic Acute 1; Aquatic Chronic 1

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H311

Toxic in contact with skin.

H300

Fatal if swallowed.

H400

Very toxic to aquatic life.

H410

Very 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

Skin Contact

Toxic

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

Fatal

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 Number2779
ADR Class6.1
Packing GroupII
Tunnel CodeD/E
Proper Shipping NameDinoterb (ISO)
Marine PollutantNo

Frequently Asked Questions

What is 2-tert-butyl-4,6-dinitrophenol?

2-tert-butyl-4,6-dinitrophenol is an organic chemical compound with the molecular formula C10H12N2O5 and CAS number 1420-07-1. This nitrophenol derivative contains a tert-butyl group and two nitro groups attached to a phenol ring, giving it a molecular weight of 240.21 g/mol. It is classified as a highly hazardous substance with reproductive toxicity, acute toxicity, and environmental dangers, requiring careful handling in industrial applications.

What are the physicochemical properties of 2-tert-butyl-4,6-dinitrophenol?

2-tert-butyl-4,6-dinitrophenol is typically a crystalline solid at room temperature with a characteristic yellow to orange color. The compound has limited water solubility due to its organic structure but dissolves well in organic solvents. Its nitro groups make it chemically reactive and potentially unstable under certain conditions. The molecular structure with both electron-withdrawing nitro groups and the bulky tert-butyl substituent influences its physical and chemical behavior.

What is 2-tert-butyl-4,6-dinitrophenol used for?

2-tert-butyl-4,6-dinitrophenol is primarily used as a chemical intermediate in the synthesis of other organic compounds and as a research chemical in laboratory applications. It may serve as a precursor in the production of dyes, pharmaceuticals, or agrochemicals. Due to its high toxicity profile and environmental hazards, its applications are typically limited to specialized industrial processes where proper safety measures and waste management systems are in place.

How to handle 2-tert-butyl-4,6-dinitrophenol safely?

2-tert-butyl-4,6-dinitrophenol requires strict safety protocols including full personal protective equipment: chemical-resistant gloves, safety goggles, respiratory protection, and protective clothing. Work must be conducted in well-ventilated areas or under fume hoods to prevent inhalation exposure. Avoid skin contact and ingestion completely due to its acute toxicity classification. Only trained personnel should handle this substance, and emergency procedures must be readily available given its dangerous classification under GHS pictograms GHS08, GHS06, and GHS09.

How to store 2-tert-butyl-4,6-dinitrophenol correctly?

2-tert-butyl-4,6-dinitrophenol must be stored in a cool, dry, well-ventilated area away from heat sources, direct sunlight, and incompatible materials. Keep containers tightly sealed and use appropriate secondary containment to prevent environmental release. Store separately from oxidizing agents, reducing agents, and bases due to potential chemical incompatibilities. The storage area should be secure, clearly labeled, and accessible only to authorized personnel familiar with the substance's hazardous properties and emergency procedures.

What to do in case of contact with 2-tert-butyl-4,6-dinitrophenol?

Immediate medical attention is required for any exposure to 2-tert-butyl-4,6-dinitrophenol due to its acute toxicity. For skin contact, remove contaminated clothing and rinse affected area with copious amounts of water for at least 15 minutes. If inhaled, move to fresh air immediately and monitor breathing. In case of eye contact, flush with water for 15 minutes while holding eyelids open. Never induce vomiting if ingested. Contact poison control and seek emergency medical care immediately for any exposure route.

How to dispose of 2-tert-butyl-4,6-dinitrophenol appropriately?

2-tert-butyl-4,6-dinitrophenol must be disposed of as hazardous waste through licensed waste management companies specialized in toxic chemical disposal. Never discharge into sewers, water bodies, or regular waste streams due to its environmental toxicity classification (Aquatic Acute 1, Aquatic Chronic 1). Incineration at high temperatures in appropriate facilities is typically required. All disposal activities must comply with local, national, and EU waste regulations, and proper waste classification codes must be assigned for tracking and documentation purposes.

How to transport 2-tert-butyl-4,6-dinitrophenol?

2-tert-butyl-4,6-dinitrophenol is classified under ADR as Class 6.1 (toxic substances), Packing Group II, indicating significant transport hazards. Shipments require appropriate UN-specification packaging, proper labeling with toxic substance markings, and transport documentation including safety data sheets. Vehicles must carry emergency equipment and drivers need hazardous materials certification. Transport must comply with ADR regulations for toxic substances, including route restrictions, quantity limitations, and emergency response procedures during transit.

Is 2-tert-butyl-4,6-dinitrophenol subject to special regulations?

2-tert-butyl-4,6-dinitrophenol is subject to comprehensive chemical regulations including REACH registration requirements in the EU and CLP classification as a Category 1B reproductive toxicant. While not currently listed as an SVHC, its reproductive toxicity classification subjects it to authorization and restriction considerations. Users must comply with occupational exposure limits, environmental discharge restrictions, and worker health surveillance requirements. Import/export may require permits, and industrial users need risk assessments and appropriate risk management measures.

Where to buy 2-tert-butyl-4,6-dinitrophenol in Europe?

2-tert-butyl-4,6-dinitrophenol is available through OYSI, a specialized European distributor of technical chemicals with expertise in hazardous substance supply. As an established chemical distributor, OYSI provides proper documentation, safety data sheets, and regulatory compliance support for this highly regulated substance. Professional buyers requiring this compound for legitimate industrial or research applications can contact OYSI for availability, specifications, and regulatory guidance to ensure proper procurement and handling procedures are followed.

Data Sources

Classification per CLP Regulation (EC) No 1272/2008. Data from ECHA and PubChem.