1. Chemical Structure and Properties
Molecular Formula: C₁₄H₂₆O₄
Structural Formula: CH₂CH₂COO(CH₂)₃CH₃ — A diester compound formed by the reaction of adipic acid with butanol.
Physical Properties:
Appearance: Clear, colorless to pale yellow oily liquid with a faint ester-like odor.
Boiling Point: 305°C; Density: 0.96 g/cm³; Vapor Pressure: 0.001 mmHg at 25°C.
Solubility: Insoluble in water; miscible with most organic solvents (ethanol, acetone, ether).
Chemical Properties:
Stability: Hydrolyzes slowly under strong acidic/alkaline conditions; stable under normal storage.
Flammability: Combustible liquid (flash point: 148°C).
Viscosity: ~10 mPa·s at 20°C.
2. Industrial Applications
Plasticizers:
Primary Use: Secondary plasticizer for PVC, improving flexibility and cold resistance in cables, flooring, and films.
Synergy: Often blended with primary phthalate-free plasticizers (e.g., DINCH) to enhance performance.
Cosmetics:
Emollient: Used in lotions, creams, and hair conditioners for its non-greasy texture.
Lubricants:
Synthetic Base Oil: Reduces friction in industrial machinery and food-grade applications.
Coatings:
Solvent: Carrier for resins in automotive and wood coatings.
3. Safety and Toxicology
Health Hazards:
Acute Exposure:
Oral LD₅₀ (Rat): >5,000 mg/kg (practically non-toxic).
Skin Irritation: Mild irritation (rabbit skin LD₅₀: >2,000 mg/kg).
Eye Exposure: Transient discomfort (OECD 405 compliant).
Chronic Effects:
No evidence of carcinogenicity (IARC: Not listed); low reproductive toxicity (OECD 421/422).
Handling Precautions:
PPE: Nitrile gloves and safety goggles for bulk handling.
Storage: Inert containers away from strong acids/bases.
4. Environmental and Regulatory Compliance
Environmental Impact:
Aquatic Toxicity: LC₅₀ (fish, 96h): >100 mg/L; EC₅₀ (daphnia): >50 mg/L.
Biodegradability: Readily biodegradable (OECD 301F: >70% in 28 days).
Persistence: Low bioaccumulation potential (log Kow: 4.5).
Regulatory Frameworks:
EU: REACH-registered; exempt from SVHC listing.
USA: FDA 21 CFR 175.300 compliant for indirect food contact; EPA TSCA-listed.
China: GB 9685-2016 approved for food packaging materials.
Transport:
UN Number: Non-hazardous; general chemical transport.
5. Case Studies and Application Insights
Case 1: Eco-Friendly PVC Flooring:
Application: Replaced 30% of DINCH with dibutyl adipate in PVC flooring to meet EU REACH low-VOC standards.
Result: 15% improvement in low-temperature flexibility (-20°C).
Case 2: Food-Grade Lubricant Formulation:
Process: Blended with polyalkylene glycol (PAG) for NSF H1-certified lubricants in bottling plants.
Performance: Reduced wear by 40% vs. mineral oil-based lubricants.
Comparative Analysis:
Dibutyl Adipate vs. Dioctyl Adipate (DOA):
Pros: Lower viscosity, better compatibility with polar polymers.
Cons: Higher volatility limits use in high-temperature applications.