4-chloro-3,5-dimethylphenol

C8H9ClO

CAS88-04-0
GHS07 Gefahrensymbol: Gesundheitsschädlich/Reizend – Ausrufezeichen
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Identification

CAS Number
88-04-0
EC Number
201-793-8
UN Number
2811
Index Number
604-038-00-4
PubChem CID
2723

Physical-chemical properties

Molecular Formula
C8H9ClO
Molar Mass
156.61 g/mol
IUPAC Name
4-chloro-3,5-dimethylphenol

Chemical Identifiers

InChI
InChI=1S/C8H9ClO/c1-5-3-7(10)4-6(2)8(5)9/h3-4,10H,1-2H3
InChI Key
OSDLLIBGSJNGJE-UHFFFAOYSA-N

Overview

4-chloro-3,5-dimethylphenol (CAS 88-04-0) is a chlorinated phenolic compound with antimicrobial and preservative properties. This halogenated aromatic compound, also known by its IUPAC name 4-chloro-3,5-dimethylphenol, represents an important member of the chlorophenol family used extensively in industrial applications. With a molecular formula of C8H9ClO and molecular weight of 156.61 g/mol, this white to pale yellow crystalline solid exhibits the characteristic properties of substituted phenols, combining the reactivity of the phenolic hydroxyl group with the electron-withdrawing effects of chlorine substitution. The compound's chemical structure features a benzene ring with three substituents: a chlorine atom at the para position and two methyl groups at the meta positions relative to the hydroxyl group. This specific substitution pattern influences both its physical properties and biological activity, making it particularly effective as a biocide and preservative agent. Unlike simpler compounds such as 4-nitrophenol, the methyl substituents in 4-chloro-3,5-dimethylphenol enhance its lipophilicity and membrane penetration capabilities. From a safety perspective, this substance requires careful handling as it is classified under GHS as Acute Tox. 4, Skin Irrit. 2, Eye Irrit. 2, and Skin Sens. 1, carrying the warning pictogram GHS07. Transport regulations classify it under ADR class 6.1, reflecting its toxic properties that necessitate appropriate safety measures during storage, handling, and transportation. Primary industrial applications include its use as an antimicrobial preservative in metalworking fluids, as an intermediate in pharmaceutical synthesis, and as a biocide in industrial water treatment systems. Its effectiveness against bacteria and fungi makes it valuable in formulations requiring long-term microbial stability. OYSI provides high-quality 4-chloro-3,5-dimethylphenol to meet diverse industrial requirements across European markets.

Safety & Classification

Warning
Classification:

Acute Tox. 4 *; Skin Irrit. 2; Eye Irrit. 2; Skin Sens. 1

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H302

Harmful if swallowed.

H315

Causes skin irritation.

H319

Causes serious eye irritation.

H317

May cause an allergic skin reaction.

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

Irritant

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

Harmful

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 Number2811
ADR Class6.1
Packing GroupII
Tunnel CodeD/E
Proper Shipping Name4-Chlor-3,5-dimethylphenol, fest
Marine PollutantNo

Frequently Asked Questions

What is 4-chloro-3,5-dimethylphenol?

4-chloro-3,5-dimethylphenol is an aromatic chlorinated phenolic compound with the molecular formula C8H9ClO and CAS number 88-04-0. This organic chemical features a benzene ring substituted with one chlorine atom and two methyl groups in addition to a hydroxyl group. With a molecular weight of 156.61 g/mol, it belongs to the family of chlorophenols and exhibits properties typical of substituted phenolic compounds used in various industrial applications.

What are the physicochemical properties of 4-chloro-3,5-dimethylphenol?

4-chloro-3,5-dimethylphenol typically appears as a white to off-white crystalline solid at room temperature with a characteristic phenolic odor. The compound has moderate solubility in water and good solubility in organic solvents such as alcohols, ethers, and aromatic hydrocarbons. Its chlorinated aromatic structure provides stability while the phenolic hydroxyl group contributes to its reactivity and solubility characteristics, making it suitable for various chemical synthesis applications.

What is 4-chloro-3,5-dimethylphenol used for?

4-chloro-3,5-dimethylphenol serves primarily as an intermediate in the synthesis of pharmaceuticals, agrochemicals, and specialty chemicals. It is commonly used in the production of antimicrobial agents, preservatives, and disinfectants due to its phenolic structure. The compound also finds applications in polymer chemistry as a building block for resins and as a precursor for various organic syntheses in fine chemical manufacturing and research laboratories.

How to handle 4-chloro-3,5-dimethylphenol safely?

4-chloro-3,5-dimethylphenol requires careful handling with appropriate personal protective equipment including chemical-resistant gloves, safety goggles, and protective clothing to prevent skin and eye contact. Work should be conducted in well-ventilated areas or under fume hoods to avoid inhalation. The compound is classified as Acute Tox. 4, Skin Irrit. 2, Eye Irrit. 2, and Skin Sens. 1, requiring awareness of potential skin sensitization and irritation risks during manipulation.

How to store 4-chloro-3,5-dimethylphenol correctly?

4-chloro-3,5-dimethylphenol should be stored in tightly sealed containers in a cool, dry, well-ventilated area away from direct sunlight and heat sources. Keep away from incompatible materials such as strong oxidizing agents, strong bases, and reactive metals. Storage areas should be equipped with appropriate spill containment measures and maintained at stable temperatures to prevent degradation. Ensure containers are properly labeled and stored according to local chemical storage regulations.

What to do in case of contact with 4-chloro-3,5-dimethylphenol?

Immediate action is required upon contact with 4-chloro-3,5-dimethylphenol. For skin contact, remove contaminated clothing and wash affected area thoroughly with soap and water for at least 15 minutes. In case of eye contact, flush immediately with clean water for 15 minutes while holding eyelids open. If inhaled, move to fresh air immediately. Seek medical attention if irritation persists or if ingestion occurs. Do not induce vomiting if swallowed.

How to dispose of 4-chloro-3,5-dimethylphenol appropriately?

4-chloro-3,5-dimethylphenol waste must be disposed of according to local and national hazardous waste regulations as it contains chlorinated organic compounds. Contact licensed hazardous waste disposal companies for proper treatment and disposal. Do not discharge into drains, waterways, or soil. Small laboratory quantities may require specific collection and treatment procedures. Maintain proper documentation of disposal activities and follow all applicable environmental regulations for halogenated organic waste streams.

How to transport 4-chloro-3,5-dimethylphenol?

4-chloro-3,5-dimethylphenol is classified under ADR Class 6.1 (toxic substances), Packing Group II, requiring appropriate hazardous materials packaging and documentation for transport. Shipments must use UN-approved packaging suitable for toxic solids and be accompanied by proper shipping papers, emergency response information, and hazard labels. Transport vehicles must comply with ADR regulations for Class 6.1 materials, including appropriate placarding and driver certification requirements.

Is 4-chloro-3,5-dimethylphenol subject to specific regulations?

4-chloro-3,5-dimethylphenol is subject to REACH regulation requiring registration for manufacture or import above specified tonnages in the EU. The compound is classified under CLP regulation with harmonized classification requiring appropriate labeling with GHS07 pictogram and 'Warning' signal word. While not currently identified as SVHC, it remains subject to standard chemical safety assessment requirements and may be subject to additional national restrictions depending on specific applications and use patterns.

Where to buy 4-chloro-3,5-dimethylphenol in Europe?

4-chloro-3,5-dimethylphenol is available through OYSI, a European distributor of specialty chemicals serving industrial and research customers across the continent. OYSI provides reliable supply chains for laboratory and industrial quantities with appropriate technical documentation and regulatory compliance support. Contact OYSI directly for availability, specifications, and delivery options to your location. Professional chemical distributors ensure proper handling, packaging, and documentation for safe delivery of this regulated substance.

Data Sources

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