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Ethyl Vanillin, Ethoxy Vanillin, 121–32–4

Ethyl Vanillin, Ethoxy Vanillin, 121–32–4

ETHYL VANILLIN

PRODUCT IDENTIFIER INFORMATION

Parameter Information
Product Name Ethyl Vanillin
Chemical Name (IUPAC) 3-Ethoxy-4-hydroxybenzaldehyde
CAS Number 121-32-4
EC Number (EINECS) 204-464-7
FEMA Number 2464
Molecular Formula C9H10O3
Molecular Weight 166.17 g/mol

SECTION 1: CHEMICAL IDENTITY AND DESCRIPTION

Parameter Information
Chemical Name (IUPAC) 3-Ethoxy-4-hydroxybenzaldehyde
Systematic Name 4-Hydroxy-3-ethoxybenzaldehyde
Synonyms Ethyl Vanillin, Vanillin Ethyl Ether, Ethoxy Vanillin, Ethavan, Bourbonal, 3-Ethoxy-4-hydroxybenzaldehyde
CAS Number 121-32-4
EC Number (EINECS) 204-464-7
FEMA Number 2464
Molecular Formula C9H10O3
Molecular Weight 166.17 g/mol
Chemical Class Phenolic aldehyde (vanillin derivative); synthetic flavor compound
Physical State (20°C) Solid (white to slightly yellow/off-white crystalline powder)
Odor Intense vanilla-like; 3-4 times stronger and more elegant than vanillin
Taste Sweet, vanilla-like characteristic flavor

SECTION 2: PHYSICAL AND CHEMICAL PROPERTIES

Property Value Test Method
Appearance White to slightly yellow/off-white crystalline powder Visual
Odor Intense vanilla; 3-4 times stronger and more elegant than vanillin Olfactometric
Taste Sweet, vanilla-like Sensory
Molecular Weight 166.17 g/mol Calculated
Melting Point 76 – 78°C DSC
Boiling Point No distinct boiling point; thermodynamically decomposes TGA
Density (20°C) 1.11 g/cm3 ASTM D4052
Solubility in Water (25°C) Slightly soluble (~1-2 g/L) Gravimetric
Solubility in Ethanol Soluble General Method
Solubility in Propylene Glycol Soluble General Method
Solubility in Glycerin Soluble General Method
Solubility in Organic Solvents Soluble in ether, chloroform General Method
Stability Stable under normal conditions; light-sensitive  
Flash Point >100°C ASTM D93

SECTION 3: CHEMICAL PROPERTIES AND REACTIVITY

Parameter Information
Chemical Character Phenolic aldehyde; vanillin analog (contains ethoxy group)
Stability Stable under normal conditions; light-sensitive
Decomposition Products (Heating) Thermodynamic decomposition; CO, CO2, phenolic compounds
Incompatible Materials Strong oxidizing agents, strong acids, strong bases
Difference from Vanillin Ethyl vanillin has 3-4 times stronger aroma intensity than vanillin
Hazardous Polymerization Does not occur

SECTION 4: VANILLIN AND DERIVATIVES COMPARISON

Property Ethyl Vanillin Vanillin Methyl Vanillin
CAS Number 121-32-4 121-33-5 120-14-9
Molecular Formula C9H10O3 C8H8O3 C9H10O3
Molecular Weight 166.17 152.15 166.17
Melting Point 76-78°C 81-83°C 42-43°C
Aroma Strength (Vanillin=1) 3-4 1 1-2
Odor Profile Intense, elegant vanilla Classic vanilla Sweet, creamy vanilla
FEMA Number 2464 3107 -
Food Additive Code Flavoring Flavoring Flavoring
Primary Use Confectionery, beverages, cosmetics Food, flavor, cosmetics Perfumery

SECTION 5: FUNCTIONAL PROPERTIES AND MECHANISM OF ACTION

Property Description
Intense Flavoring Agent 3-4 times stronger aroma intensity than vanillin; effective at low dosage
Sweetener and Flavor Enhancer Provides sweet, creamy vanilla flavor to foods; enhances other flavors
Odor Masking Agent Masks undesirable odors in pharmaceutical and cosmetic products
Antioxidant Exhibits antioxidant properties due to its phenolic structure
Anti-inflammatory Possesses potential anti-inflammatory effects
Heat Stability Resistant to baking temperatures in bakery products
UV Protector Forms UV-resistant coating in plastic and coating industries

SECTION 6: PRIMARY APPLICATION AREAS

Sector / Application Use Typical Concentration / Dosage
Food - Confectionery, Chocolate Flavoring agent, sweetener 50 – 250 ppm
Food - Bakery (Cakes, Biscuits) Flavoring agent, heat stability advantage 50 – 200 ppm
Food - Ice Cream, Frozen Desserts Enhancing vanilla notes 30 – 150 ppm
Food - Beverages (Soft Drinks, Flavored) Sweetener, flavoring agent 10 – 100 ppm
Food - Dairy-Based Products Flavor especially suitable for dairy-based foods 30 – 150 ppm
Cosmetic - Perfumes Fragrance agent, fixative 0.1 – 2.0%
Cosmetic - Lotions, Shampoos Providing pleasant fragrance 0.05 – 0.5%
Pharmaceutical - Syrups, Tablets Sweetener, odor masking 0.05 – 0.3%
Tobacco Industry Flavor additive Variable
Plastic / Coatings Fragrance agent, UV protector 0.1 – 1.0%

SECTION 7: QUALITY SPECIFICATIONS (FOOD/FLAVOR GRADE)

Parameter Specification Test Method
Appearance White to slightly yellow crystalline powder Visual
Odor Intense vanilla, characteristic Olfactometric
Purity (GC) ≥ 99.0% GC-FID
Melting Range 76 – 78°C DSC / Capillary Tube
Loss on Drying (105°C, 2 hours) ≤ 0.5% Gravimetric
Ash Content ≤ 0.05% Gravimetric (600°C)
Heavy Metals (as Pb) ≤ 10 ppm ICP-MS
Lead (Pb) ≤ 2 ppm ICP-MS
Arsenic (As) ≤ 3 ppm ICP-MS
Mercury (Hg) ≤ 1 ppm ICP-MS
Cadmium (Cd) ≤ 1 ppm ICP-MS
Total Microbial Count ≤ 1,000 CFU/g ISO 4833
Yeast and Mold ≤ 100 CFU/g ISO 21527
E. coli Negative in 10g ISO 16649
Salmonella spp. Negative in 25g ISO 6579

SECTION 8: TOXICOLOGICAL PROFILE

Parameter Value
Acute Oral Toxicity (LD50, Rat) > 2,000 mg/kg
Skin Irritation May be mildly irritating
Eye Irritation May be irritating
Respiratory Irritation Inhalation of dust may cause mechanical irritation
Skin Sensitization Low risk; allergic reaction in sensitive individuals
Carcinogenicity Not classified
Mutagenicity Negative in in vitro tests
ADI (Acceptable Daily Intake) 0-3 mg/kg body weight/day (JECFA)
GRAS Status FEMA GRAS (2464)

SECTION 9: GHS CLASSIFICATION AND LABELING

GHS Classification (compliant with 1272/2008/EC):

Hazard Class Category H-Statement
Skin Irritation Category 2 H315
Eye Irritation Category 2 H319
STOT - SE Category 3 H335

Signal Word: WARNING

Hazard Pictograms: GHS07 (Exclamation Mark)

Hazard Statements (H-Codes):

Code Statement
H315 Causes skin irritation
H319 Causes serious eye irritation
H335 May cause respiratory irritation

Precautionary Statements (P-Codes):

Code Statement
P261 Avoid breathing dust
P280 Wear protective gloves/eye protection
P302+P352 IF ON SKIN: Wash with plenty of water and soap
P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes

SECTION 10: FIRST AID MEASURES

Exposure Route Action to Take
Inhalation Move to fresh air. Seek medical attention if respiratory irritation persists.
Skin Contact Wash with plenty of water and soap for at least 15 minutes. Seek medical attention if irritation persists.
Eye Contact Rinse immediately with plenty of water for at least 15 minutes. Remove contact lenses if present. Seek medical attention.
Ingestion Rinse mouth with water. Drink plenty of water. Seek medical attention if you feel unwell.

SECTION 11: FIREFIGHTING MEASURES

Parameter Information
Fire Hazard Combustible organic powder
Hazards During Fire CO, CO2, phenolic compounds
Suitable Extinguishing Media Water mist, CO2, dry chemical powder, foam
Special Protective Equipment Self-contained breathing apparatus (SCBA), full protective clothing
Special Precautions Prevent dust accumulation; avoid sparks

SECTION 12: STORAGE AND SHELF LIFE

Parameter Information
Storage Conditions Cool (15-25°C), dry, well-ventilated area; protect from direct light
Container Requirements Tightly closed, light-resistant containers
Keep Away From Light (light-sensitive), strong oxidizing agents, strong acids, strong bases
Shelf Life 36 months (unopened original packaging under appropriate storage conditions)
Stability Note Light-sensitive; store in light-resistant containers

SECTION 13: PACKAGING OPTIONS

Packaging Type Quantity Material
Aluminum foil pouch (light-protective) 1 kg Laminated aluminum
Aluminum foil pouch (light-protective) 5 kg Laminated aluminum
Kraft bag with PE inner liner 25 kg Kraft paper + PE
Fiber drum (light-protected) 25-50 kg Fiberboard + PE

SECTION 14: TRANSPORTATION INFORMATION

Parameter Information
UN Number Not regulated (not hazardous)
Hazard Class Not applicable
Packing Group Not applicable
ADR/RID Not regulated
IMDG Code Not regulated
IATA (Air) Not regulated
Marine Pollutant No
Transport Temperature Ambient; protect from light and moisture

SECTION 15: REGULATORY STATUS

Region / Authority Status
European Union Approved as flavoring substance (EC 1334/2008)
USA (FDA) FEMA GRAS (2464); approved for food flavor use
JECFA (FAO/WHO) ADI: 0-3 mg/kg body weight/day
Turkey Approved under Turkish Food Codex Flavoring Regulation
Halal / Kosher Available
Vegetarian/Vegan Suitable (synthetic origin)

SECTION 16: OTHER NAMES AND SYNONYMS

Type Name
Common Names Ethyl Vanillin, Vanillin Ethyl Ether, Ethoxy Vanillin
Chemical Names 3-Ethoxy-4-hydroxybenzaldehyde, 4-Hydroxy-3-ethoxybenzaldehyde
Trade Names Ethavan, Bourbonal
FEMA Number 2464
CAS Number 121-32-4
EC Number 204-464-7

SECTION 17: VANILLIN MARKET FORMS COMPARISON

Property Ethyl Vanillin Vanillin Vanilla Extract
Source Synthetic Synthetic/Natural Natural (vanilla beans)
Aroma Strength 3-4x vanillin 1x (reference) Variable
Cost Medium Low High
Consistency Excellent Excellent Variable
Labeling "Artificial Flavor" "Natural" or "Artificial" "Natural Flavor"
Heat Stability Excellent Good Moderate
Primary Use High-intensity vanilla flavor General vanilla flavor Premium natural products

SECTION 18: SUMMARY TABLE

Parameter Value
Product Ethyl Vanillin
CAS Number 121-32-4
FEMA Number 2464
Molecular Formula C9H10O3
Molecular Weight 166.17 g/mol
Appearance White to slightly yellow crystalline powder
Melting Point 76 – 78°C
Aroma Strength (Vanillin=1) 3-4 times
Primary Function Intense vanilla flavoring agent, sweetener
Shelf Life 36 months
GHS Signal Word Warning

SECTION 19: CRITICAL WARNINGS AND BEST PRACTICES

CRITICAL WARNINGS:

  1. Light Sensitivity: Light-sensitive; store in light-resistant containers away from direct sunlight.

  2. Dust Control: Fine dust may cause mechanical respiratory irritation. Use dust mask in dusty environments.

  3. High Potency: 3-4 times stronger than vanillin; use proportionally lower dosage to avoid over-flavoring.

  4. Skin/Eye Irritation: May cause irritation upon direct contact. Use protective equipment.

  5. Solubility: Limited water solubility (~1-2 g/L); pre-dissolve in ethanol or propylene glycol for aqueous formulations.

BEST PRACTICE RECOMMENDATIONS:

  1. Dosage Control: Start with 1/3 to 1/4 of vanillin dosage when substituting; typical usage 10-250 ppm depending on application.

  2. Pre-dissolution: Pre-dissolve in ethanol, propylene glycol, or glycerin before adding to aqueous-based formulations.

  3. Dairy Products: Particularly suitable for dairy-based flavors due to its elegant aroma profile.

  4. Heat Stability: Excellent heat stability makes it ideal for bakery and confectionery applications.

  5. Storage: Store in cool, dry, dark environment in tightly sealed containers.

LEGAL DISCLAIMER:

The information provided in this document is presented in good faith based on our current knowledge and experience; however, since all usage conditions are beyond our control, it does not constitute a binding specification or warranty. This Technical Data Sheet is for informational purposes only. Users are obligated to test the suitability for their own applications. For complete safety, storage, handling, transportation, disposal, and regulatory compliance information, refer to the official Safety Data Sheet (SDS/MSDS) provided by the manufacturer/supplier.

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