2,3,4,5,6-pentachlorophenol

C6HCl5O

CAS87-86-5
GHS08 Gefahrensymbol: Gesundheitsgefahr – Gesundheitsgefahr
GHS06 Gefahrensymbol: Giftig – Totenkopf mit Knochen
GHS09 Gefahrensymbol: Umweltgefährlich – Umwelt
Danger

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Identification

CAS Number
87-86-5
EC Number
201-778-6
UN Number
3155
Index Number
604-002-00-8
PubChem CID
992

Physical-chemical properties

Molecular Formula
C6HCl5O
Molar Mass
266.30 g/mol
IUPAC Name
2,3,4,5,6-pentachlorophenol

Chemical Identifiers

InChI
InChI=1S/C6HCl5O/c7-1-2(8)4(10)6(12)5(11)3(1)9/h12H
InChI Key
IZUPBVBPLAPZRR-UHFFFAOYSA-N

Overview

2,3,4,5,6-pentachlorophenol (CAS 87-86-5) is a highly chlorinated phenolic compound with potent antimicrobial and preservative properties. This organochlorine chemical represents one of the most extensively chlorinated derivatives in the phenol family, featuring five chlorine atoms substituted on the benzene ring. The compound appears as a white to light tan crystalline solid with a characteristic phenolic odor and demonstrates significant stability under normal storage conditions. Its molecular structure, with the formula C6HCl5O and molecular weight of 266.3 g/mol, contributes to its effectiveness as a biocide while also presenting considerable safety considerations. The extensive chlorination pattern of 2,3,4,5,6-pentachlorophenol results in enhanced lipophilicity and bioaccumulation potential compared to less chlorinated phenolic compounds. This chemical exhibits broad-spectrum antimicrobial activity against bacteria, fungi, and algae, making it valuable in specific industrial preservation applications. Related compounds in this chemical family include sodium 2,3,4,5,6-pentachlorophenolate, which serves as the sodium salt derivative with modified solubility characteristics. Safety classification under CLP regulation identifies this substance with multiple hazard categories including carcinogenicity (Category 2), acute toxicity, and environmental hazards, requiring specialized handling protocols and appropriate personal protective equipment. The compound carries GHS pictograms for health hazards (GHS08), acute toxicity (GHS06), and environmental dangers (GHS09). Industrial applications primarily focus on specialized wood preservation systems, certain textile treatments, and specific antimicrobial formulations where its unique properties provide technical advantages. The substance also finds use in research and development applications requiring potent phenolic antimicrobial agents. OYSI maintains availability of 2,3,4,5,6-pentachlorophenol for qualified industrial customers with appropriate handling capabilities and regulatory compliance requirements.

Safety & Classification

Danger
Classification:

Carc. 2; Acute Tox. 2 *; Acute Tox. 3 *; Acute Tox. 3 *; STOT SE 3; Skin Irrit. 2; Eye Irrit. 2; ...

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H351

Suspected of causing cancer.

H330

Fatal if inhaled.

H311

Toxic in contact with skin.

H301

Toxic if swallowed.

H335

May cause respiratory irritation.

H315

Causes skin irritation.

H319

Causes serious eye irritation.

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

Inhalation

Fatal

Measures if vapours or dust are inhaled

First Aid Actions

  • +P304IF INHALED:
  • +P340Remove person to fresh air and keep comfortable for breathing.
  • +P311Call a POISON CENTER/doctor.

Related hazard statements:

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:

Eye Contact

Irritant

Measures if substance gets into the eyes

First Aid Actions

  • +P305IF IN EYES:
  • +P351Rinse cautiously with water for several minutes.
  • +P338Remove contact lenses, if present and easy to do. Continue rinsing.
  • +P313Get medical advice/attention.

Related hazard statements:

Ingestion

Toxic

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 Number3155
ADR Class6.1
Packing GroupII
Tunnel CodeD/E
Proper Shipping NamePentachlorphenol, rein
Marine PollutantNo

Frequently Asked Questions

What is 2,3,4,5,6-pentachlorophenol?

2,3,4,5,6-pentachlorophenol is a chlorinated phenolic compound with the molecular formula C6HCl5O and CAS number 87-86-5. This organochlorine substance has a molecular weight of 266.3 g/mol and belongs to the family of polychlorinated phenols. It is classified as a hazardous chemical with multiple health and environmental risks, including carcinogenic properties (Category 2) and acute toxicity. The compound requires careful handling due to its dangerous classification under GHS regulations.

What are the physicochemical properties of 2,3,4,5,6-pentachlorophenol?

2,3,4,5,6-pentachlorophenol is typically a white to light yellow crystalline solid at room temperature with a characteristic phenolic odor. The compound has low water solubility but dissolves well in organic solvents such as alcohols, acetone, and benzene. It exhibits stability under normal conditions but can decompose when heated, potentially releasing toxic chlorinated compounds. The substance's high chlorine content contributes to its persistence in the environment and bioaccumulation potential.

What is 2,3,4,5,6-pentachlorophenol used for?

2,3,4,5,6-pentachlorophenol is primarily used as a biocide and preservative in industrial applications. It serves as a wood preservative, fungicide, and bactericide in various industrial processes. The compound is also utilized in the synthesis of other chemical intermediates and as a component in some specialty chemical formulations. However, its use has become increasingly restricted due to environmental and health concerns, with many applications being phased out in favor of safer alternatives.

How to handle 2,3,4,5,6-pentachlorophenol safely?

2,3,4,5,6-pentachlorophenol requires strict safety measures including chemical-resistant gloves, safety goggles, and respiratory protection when handling. Work should be conducted in well-ventilated areas or under fume hoods to prevent inhalation exposure. Protective clothing should cover all exposed skin due to the substance's skin irritation properties. Avoid direct contact, ingestion, and inhalation. Emergency eyewash stations and safety showers should be readily accessible, and personnel should be trained in proper handling procedures.

How to store 2,3,4,5,6-pentachlorophenol correctly?

2,3,4,5,6-pentachlorophenol should be stored in tightly sealed containers in a cool, dry, well-ventilated area away from heat sources and incompatible materials. Keep containers away from strong bases, oxidizing agents, and reactive metals. Storage areas should be secured and accessible only to authorized personnel. Containers should be properly labeled according to GHS requirements and regularly inspected for integrity. Maintain storage temperatures below decomposition point and protect from moisture to prevent degradation.

What to do in case of contact with 2,3,4,5,6-pentachlorophenol?

In case of skin contact with 2,3,4,5,6-pentachlorophenol, immediately remove contaminated clothing and wash affected area thoroughly with soap and water for at least 15 minutes. For eye contact, rinse immediately with clean water for 15-20 minutes and remove contact lenses if present. If inhaled, move person to fresh air immediately. In case of ingestion, do not induce vomiting and seek immediate medical attention. Always consult a physician after exposure and provide the safety data sheet to medical personnel.

How to dispose of 2,3,4,5,6-pentachlorophenol appropriately?

2,3,4,5,6-pentachlorophenol must be disposed of as hazardous waste through licensed waste management facilities capable of handling toxic and potentially carcinogenic materials. The substance cannot be disposed of in regular waste streams or sewage systems due to its environmental persistence and toxicity. Incineration at high temperatures in specialized facilities may be required. Always consult local environmental authorities and follow applicable waste disposal regulations including proper documentation and manifesting procedures.

How to transport 2,3,4,5,6-pentachlorophenol?

2,3,4,5,6-pentachlorophenol is classified under ADR as Class 6.1 (Toxic substances), Packing Group II, indicating moderate toxicity requiring specific transport precautions. Packages must be properly labeled with appropriate hazard labels and markings according to dangerous goods regulations. Transport vehicles should carry appropriate emergency equipment and documentation. Drivers must be trained in dangerous goods transport, and shipments require proper dangerous goods declarations. Ensure compliance with national and international transport regulations for toxic substances.

Is 2,3,4,5,6-pentachlorophenol subject to specific regulations?

2,3,4,5,6-pentachlorophenol is subject to strict regulations under REACH, CLP, and various national chemical control laws due to its carcinogenic and toxic properties. The substance requires safety data sheets, proper classification and labeling according to GHS standards with 'Danger' signal word. Its use may be restricted or prohibited in certain applications, particularly consumer products. Companies must comply with registration requirements, exposure assessments, and risk management measures. Regular monitoring of regulatory updates is essential as restrictions continue to evolve.

Where to buy 2,3,4,5,6-pentachlorophenol in Europe?

2,3,4,5,6-pentachlorophenol can be sourced through OYSI, a European distributor of technical chemicals specializing in hazardous and regulated substances. OYSI provides proper documentation, safety data sheets, and regulatory compliance support for professional customers. Due to the substance's hazardous classification and regulatory restrictions, purchases are typically limited to qualified industrial users with legitimate applications. Contact OYSI's technical team for availability, specifications, and regulatory guidance to ensure compliant procurement and handling.

Data Sources

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