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ethyl vanillin acetate

Chemical Structure

General Material Information

Preferred name ethyl vanillin acetate
Trivial Name 4-Acetoxy-3-ethoxybenzaldehyde
Short Description benzaldehyde, 4-(acetyloxy)-3-ethoxy-
Formula C11 H12 O4
CAS Number 72207-94-4
FDA UNII Search
Nikkaji Number J447.105I
Beilstein Number 3305672
xLogP3-AA 1.50 (est)
NMR Predictor External link
Synonyms
  • 4-acetoxy-3-ethoxybenzaldehyde
  • benzaldehyde, 4-(acetyloxy)-3-ethoxy-
  • 2-ethoxy-4-formyl phenyl acetate
  • 2-ethoxy-4-formyl-phenyl acetate
  • 2-ethoxy-4-formylphenyl acetate
  • (2-ethoxy-4-formylphenyl) acetate
  • (2-ethoxy-4-formylphenyl) acetate
  • Benzaldehyde, 3-ethoxy-4-hydroxy-, acetate
  • 4-(Acetyloxy)-3-ethoxybenzaldehyde
  • 4-Acetoxy-3-ethoxybenzaldehyde
  • Ethylvanillin acetate

US / EU / FDA / JECFA / FEMA / Scholar / Patents

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Other Information

(IUPAC):Atomic Weights of the Elements 2011 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2915.39.9050
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 208.21343994141
Boiling Point 303 to 305°C @ 760 mm Hg
Vapor Pressure 0.001 mmHg @ 25 °C
Flash Point TCC Value 131.67 °C TCC
logP (o/w) 2.086 est
Solubility
alcohol Yes
water, 986.4 mg/L @ 25 °C (est) Yes
water No

Organoleptic Properties

Odor Type: Vanilla
vanilla, milky, creamy, caramellic, powdery
General comment At 100.00 %. vanilla milky

Safety Information

Safety information

Hazards identification
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
Pictogram
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
oral-rat LDLo 5000 mg/kg
Food and Chemical Toxicology. Vol. 26, Pg. 283, 1988.

Dermal Toxicity:
skin-rabbit LD50 > 5000 mg/kg
Food and Chemical Toxicology. Vol. 26, Pg. 283, 1988.

Inhalation Toxicity:
Not determined

Safety in use information

Category:
fragrance agents
RIFM Fragrance Material Safety Assessment: Search
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
Recommendation for ethyl vanillin acetate flavor usage levels up to:
not for flavor use.

Safety references

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):72207-94-4
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :155708
National Institute of Allergy and Infectious Diseases:Data
(2-ethoxy-4-formylphenyl) acetate
Chemidplus:0072207944