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Cetrimonium Chloride, Cetyl Trimethyl Ammonium Chloride, Hexadecyl Trimethyl Ammonium Chloride, CTAC, HTAC, 112-02-7

Cetrimonium Chloride, Cetyl Trimethyl Ammonium Chloride, Hexadecyl Trimethyl Ammonium Chloride, CTAC, HTAC, 112-02-7

CETRIMONIUM CHLORIDE (CETYL TRIMETHYL AMMONIUM CHLORIDE)

CAS 112-02-7 | C₁₉H₄₂ClN

SECTION 1: PRODUCT IDENTITY AND DEFINITION

Parameter Description
Product Name Cetrimonium Chloride
Other Names CTAC, HTAC, Cetyl Trimethyl Ammonium Chloride, Hexadecyl Trimethyl Ammonium Chloride, N-Hexadecyltrimethylammonium Chloride, C16-alkyltrimethylammonium chloride, 1631, Barquat CT 29
Chemical Formula C₁₉H₄₂ClN
Molecular Weight 320.0 g/mol
CAS Number 112-02-7
EC Number (EINECS) 203-928-6
Chemical Class Cationic Surfactant / Quaternary Ammonium Salt
Appearance White to Off-White Powder, Paste, or Flakes
Odor Slight characteristic
Source Synthetic

Description: Cetrimonium Chloride (Cetyl Trimethyl Ammonium Chloride) is a cationic quaternary ammonium salt surfactant. It is a white to off-white powder, paste, or flake solid with excellent water solubility. It is heat-resistant, light-resistant, and stable against strong acids and strong bases. It exhibits excellent surface activity, stability, and biodegradability. It has good compatibility with cationic, nonionic, and amphoteric surfactants, but is incompatible with anionic surfactants. It is widely used in hair care products (conditioners, shampoos), fabric softeners, antistatic agents, emulsifiers, corrosion inhibitors, and biocides.

SECTION 2: SYNONYMS AND OTHER NAMES

No Synonym / Other Name
1 Cetrimonium Chloride
2 Cetyl Trimethyl Ammonium Chloride
3 CTAC
4 HTAC
5 Hexadecyl Trimethyl Ammonium Chloride
6 N-Hexadecyltrimethylammonium Chloride
7 C16-alkyltrimethylammonium chloride
8 1631
9 Barquat CT 29
10 Cetyl Trimithyl Ammonium Chloride
11 (1-Hexadecyl)trimethylammonium chloride
12 Cetyltrimethylammonium Chloride (CTMAC)
13 112-02-7
14 EC 203-928-6

SECTION 3: CHEMICAL STRUCTURE AND PROPERTIES

Parameter Description
Chemical Family Cationic Surfactant / Quaternary Ammonium Salt
Structure Cetyl (C16) alkyl chain with trimethylammonium head group and chloride counterion
Functional Groups Quaternary Ammonium (N⁺), Chloride (Cl⁻)
Ionic Character Cationic (positive charge on nitrogen)
Critical Micelle Concentration (CMC) ~0.9 – 1.0 mM
HLB Value ~15 – 16

Structural Formula:

    CH₃
    |
CH₃-(CH₂)₁₅ - N⁺ - CH₃  Cl⁻
    |
    CH₃

    Hexadecyltrimethylammonium Chloride (Cetrimonium Chloride)

Key Characteristics:

  • Cationic quaternary ammonium surfactant

  • Excellent water solubility (especially in hot water)

  • Good compatibility with cationic, nonionic, and amphoteric surfactants

  • Incompatible with anionic surfactants (precipitates)

  • Heat-resistant, light-resistant, acid/alkali-resistant

  • Good stability and biodegradability

  • Excellent softening, antistatic, and emulsifying properties

  • Biocidal and antimicrobial activity

SECTION 4: PHYSICAL AND CHEMICAL PROPERTIES

Parameter Specification Typical Value Test Method
Physical State (25°C) Solid/Powder/Paste/Flakes - Visual
Appearance White – Off-White - Visual
Odor Slight characteristic - Organoleptic
Chemical Formula C₁₉H₄₂ClN - -
Molecular Weight 320.0 g/mol - -
CAS Number 112-02-7 - -
Density (25°C) ~0.968 g/mL - ASTM D4052
Melting Point 232 – 234 °C - DSC
Boiling Point 475.5 °C (estimated) - -
Water Solubility Soluble (hot water, alcohols) - -
Vapor Pressure (25°C) 0.006 Pa - -
Refractive Index (n²⁰/D) ~1.3778 - ASTM D1218
pH (50 g/L, 25°C) 6.0 – 8.5 6.5 – 7.5 USP <791>
Active Content ≥ 95% 98 – 99% Titration
Free Amine ≤ 0.5% < 0.2% Titration
Ash Content ≤ 0.5% < 0.2% USP <281>
Loss on Drying ≤ 0.5% < 0.3% USP <731>
Heavy Metals (Pb) ≤ 10 ppm < 5 ppm USP <231>
Moisture Content ≤ 1.0% < 0.5% Karl Fischer
BRN 3657974 - -
HS Code 29239000 - -

SECTION 5: FUNCTIONAL PROPERTIES

Property Description
Surfactant Cationic surfactant with excellent surface activity
Conditioning Provides softening and conditioning effects on hair and skin
Antistatic Excellent antistatic properties for fibers and fabrics
Emulsification Effective emulsifier for oils, silicone oils, and waxes
Softening Softens fibers, fabrics, and hair
Biocidal Antimicrobial and disinfectant properties
Thickening Provides viscosity build in formulations
Compatibility Compatible with cationic, nonionic, and amphoteric surfactants
Incompatibility Incompatible with anionic surfactants (forms precipitates)

SECTION 6: COSMETIC AND PERSONAL CARE APPLICATIONS

Application Function / Benefit Typical Use Level
Hair Conditioners Conditioning agent, antistatic, softener 0.5 – 3.0%
Shampoos Conditioning agent, antistatic 0.5 – 2.0%
Hair Masks Deep conditioning, softening 1.0 – 3.0%
Leave-in Conditioners Conditioning, detangling, antistatic 0.5 – 2.0%
Creams and Lotions Emulsifier, stabilizer 0.5 – 2.0%
Hair Serums Conditioning, antistatic 0.5 – 1.5%
Silicone Oil Emulsifiers Emulsifier for silicone oils 5 – 15%
Baby Care Products Mild conditioning agent 0.5 – 1.5%
Color Protection Products Conditioning, color retention 0.5 – 2.0%

Formulation Tips:

  • Do not mix directly with anionic surfactants (precipitation)

  • Can be combined with cationic and nonionic surfactants

  • Pre-dissolve in hot water (50-60°C) for easier incorporation

  • Compatible with quaternary ammonium compounds

  • pH range: 4.0 – 8.0

SECTION 7: INDUSTRIAL APPLICATIONS

Industry Application Function / Benefit
Textile Industry Fabric softener, antistatic agent Softens fibers, reduces static electricity
Fiber Processing Softening agent Glass fiber softening, polyester silk additives
Paper Industry Softening and isolation paper Softens paper, provides isolation properties
Petroleum Industry Corrosion inhibitor Prevents internal pipeline corrosion; acid treatment systems
Pickling Industry Corrosion inhibitor Protects metals during acid cleaning
Oilfield Emulsifier, corrosion inhibitor Asphalt emulsification, water treatment
Water Treatment Biocide, coagulant aid Disinfectant, flocculation, algae control
Paints & Coatings Emulsifier, dispersant Architectural coatings, waterproof coatings
Latex Industry Anti-adhesion agent Prevents sticking in latex products
Organic Synthesis Phase transfer catalyst Catalyzes organic reactions
Asphalt Emulsification Emulsifier Oil-in-water emulsion slurries
Disinfectants Biocide, sanitizer Disinfection and sterilization

SECTION 8: BIOCIDAL AND ANTIMICROBIAL PROPERTIES

Microorganism Activity
Bacteria (Gram-positive) High
Staphylococcus aureus Effective
Bacteria (Gram-negative) Moderate
Pseudomonas aeruginosa Moderate
Escherichia coli Moderate
Fungi Moderate
Candida albicans Moderate
Aspergillus niger Moderate
Algae Effective

Application as Biocide:

  • Water treatment systems

  • Cooling water treatment

  • Silkworm room disinfectants

  • Hospital disinfectants

  • Food processing sanitation

SECTION 9: ADVANTAGES AND BENEFITS

Advantage Description
Excellent Conditioning Provides superior softening and conditioning for hair and fabrics
Antistatic Properties Reduces static electricity in fibers and hair
Good Stability Heat-resistant, light-resistant, acid/alkali-resistant
Biodegradable Environmentally friendly
Versatile Suitable for cosmetics, textiles, water treatment, and industrial applications
Compatibility Good compatibility with cationic, nonionic, and amphoteric surfactants
Emulsifying Power Effective emulsifier for silicone oils and waxes
Biocidal Activity Effective antimicrobial and disinfectant properties
Ease of Formulation Readily soluble in hot water and alcohols

SECTION 10: COMPARISON WITH OTHER QUATERNARY AMMONIUM COMPOUNDS

Property Cetrimonium Chloride (C16) Cetrimonium Bromide (C16) Behentrimonium Chloride (C22) Benzalkonium Chloride
CAS Number 112-02-7 57-09-0 17301-53-6 8001-54-5
Alkyl Chain C16 C16 C22 C8-C18
Counter Ion Cl⁻ Br⁻ Cl⁻ Cl⁻
Conditioning Excellent Excellent Superior Low
Antistatic Excellent Excellent Excellent Good
Biocidal Activity Good Good Low Excellent
Water Solubility Good Good Moderate Excellent
Cosmetic Use Common Less common Common Disinfectant

SECTION 11: REGULATORY STATUS

Region / Authority Status Description
European Union Permitted Cosmetic ingredient; restricted concentrations
Turkey Permitted Compliant with EU legislation
USA (FDA) Permitted OTC monograph for certain uses
Japan Permitted Approved for cosmetic use
Canada Permitted Health Canada approved
REACH Registered EU chemical regulation compliance
TSCA Listed US Toxic Substances Control Act
EINECS 203-928-6 European Inventory of Existing Chemical Substances
UN Number 3082 Environmentally Hazardous Substance, Liquid, N.O.S.
Hazard Class 9 -
Packing Group III -
WGK Germany 3 (Severely hazardous to water) -

SECTION 12: SAFETY AND TOXICOLOGICAL PROFILE

Parameter Assessment
Acute Oral Toxicity (LD50) 250 – 300 mg/kg (rat)
Acute Dermal Toxicity (LD50) 4,300 µL/kg/24h (rabbit)
Skin Irritation Irritating (R38)
Eye Irritation Risk of serious damage (R41)
Skin Sensitization May cause sensitization (R43)
Aquatic Toxicity Very toxic to aquatic organisms (R50/53)
Carcinogenicity Not classified (IARC, NTP)
Mutagenicity Not classified
Biodegradability Readily biodegradable
Inhalation Irritating to respiratory system

GHS Classification:

  • R22 – Harmful if swallowed

  • R38 – Irritating to skin

  • R41 – Risk of serious damage to eyes

  • R43 – May cause sensitization by skin contact

  • R50/53 – Very toxic to aquatic organisms; may cause long-term adverse effects in the aquatic environment

Safety Recommendations:

  • S26: In case of eye contact, rinse with plenty of water and seek medical advice

  • S37/39: Wear suitable gloves and eye/face protection

  • S60: This material and its container must be disposed of as hazardous waste

  • S61: Avoid release to the environment

  • PPE: Chemical resistant gloves (nitrile), safety goggles, protective clothing

  • Do not mix with anionic surfactants (precipitation)

SECTION 13: STORAGE AND SHELF LIFE

Parameter Information
Storage Temperature Store below +30°C
Storage Conditions Cool, dry, well-ventilated area
Container Requirements Sealed containers; protect from moisture
Protect From Moisture, heat, anionic surfactants
Hygroscopicity Easily absorbs moisture
Shelf Life 24 – 36 months (under proper storage)
Degradation Signs Caking, color change, odor change

Packaging Options:

  • 25 kg HDPE bags/pails

  • 50 kg, 100 kg drums

  • 500 kg, 1000 kg big-bags

SECTION 14: QUALITY CERTIFICATES AND STANDARDS

Certificate / Standard Status Description
ISO 9001:2015 Certified Quality management system
ISO 14001:2015 Certified Environmental management system
REACH Registered EU chemical regulation compliance
TSCA Listed US Toxic Substances Control Act
EINECS Listed 203-928-6
Certificate of Analysis (COA) Provided with each batch Includes binding specifications
Safety Data Sheet (SDS) Available Current 16-section document
Technical Data Sheet (TDS) Available Comprehensive technical information
GMP Compliant Manufacturing quality standards

SECTION 15: DISCLAIMER AND LEGAL NOTICE

Item Description
Information Purpose This Technical Data Sheet (TDS) is for informational purposes only and does not constitute a binding specification.
Typical Values Values stated herein are based on typical laboratory results and may vary slightly between batches.
Binding Data For binding specifications, the Certificate of Analysis (COA) for each batch should be requested.
User Responsibility The user is solely responsible for determining the suitability of the product for the intended application and ensuring compliance with all applicable regulations.
SDS Requirement A current Safety Data Sheet (SDS) should be requested from the supplier prior to use.
Safety Information Safety information in this document is based on current knowledge but does not constitute a guarantee of the product's health and safety risks.
Regulatory Changes The user is responsible for monitoring local and international regulatory changes.
Product Quality Product quality is guaranteed in accordance with the standards specified in this document.
License / Patents This document does not grant any license or patent rights for use of the product.
Side Effects May cause skin and eye irritation; appropriate protective measures should be taken. Very toxic to aquatic organisms; avoid environmental release.

DISCLAIMER (LEGAL NOTICE): This Technical Data Sheet (TDS) is for informational purposes only and does not constitute a binding specification. The values stated herein are based on typical laboratory results. The user is solely responsible for determining the suitability of the product for the intended application and for ensuring compliance with all local regulations. A current Safety Data Sheet (SDS) and Certificate of Analysis (COA) should be requested prior to use. May cause skin and eye irritation; appropriate protective measures should be taken. Very toxic to aquatic organisms; avoid environmental release. This document does not grant any license or patent rights for use of the product.

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