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cinnamaldehyde butylene glycol acetal

Chemical Structure

General Material Information

Preferred name cinnamaldehyde butylene glycol acetal
Trivial Name 4-Methyl-2-(2-phenylethenyl)-1,3-dioxane
Short Description 4-methyl-2-styryl-1,3-dioxane
Formula C13 H16 O2
CAS Number 5420-98-4
FDA UNII Search
Nikkaji Number J421.765I
xLogP3-AA 2.80 (est)
Bio Activity Summary External link
NMR Predictor External link
Synonyms
  • cinnamaldehyde-1,3-butylene glycol acetal
  • cinnamic aldehyde butylene glycol acetal
  • cinnamic aldehyde butyleneglycol acetal
  • 1,3-dioxane, 4-methyl-2-(2-phenylethenyl)-
  • m- dioxane, 4-methyl-2-styryl-
  • 4-methyl-2-(2-phenyl ethenyl)-1,3-dioxane
  • 4-methyl-2-[(E)-2-phenylethenyl]-1,3-dioxane
  • 4-methyl-2-styryl-1,3-dioxane
  • 4-methyl-2-[(E)-2-phenylethenyl]-1,3-dioxane
  • 1,3-Dioxane, 4-methyl-2-(2-phenylethenyl)-
  • m-Dioxane, 4-methyl-2-styryl-
  • 4-Methyl-2-(2-phenylethenyl)-1,3-dioxane
  • 2-Styryl-4-methyl-1,3-dioxane
  • 4-Methyl-2-styryl-1,3-dioxane
  • NSC 6624

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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:2911.00.5000
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 204.26892089844
Boiling Point 297 to 298°C @ 760 mm Hg
Vapor Pressure 0.002 mmHg @ 25 °C
Flash Point TCC Value 142.1 °C TCC
logP (o/w) 2.599 est
Solubility
alcohol Yes
water, 113.4 mg/L @ 25 °C (est) Yes

Organoleptic Properties

Odor Type: Spicy
sweet, spicy, candy, cinnamon, warm
General comment At 10.00 % in propylene glycol. sweet spice candy cinnamon red hots warm

Potential Uses

Applications
Odor purposes Cinnamon, Spice

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:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined

Safety in use information

Category:
information only not used for fragrances or flavors
Recommendation for cinnamaldehyde butylene glycol acetal usage levels up to:
not for fragrance use.
Recommendation for cinnamaldehyde butylene glycol acetal 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):5420-98-4
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :5905098
National Institute of Allergy and Infectious Diseases:Data
4-methyl-2-[(E)-2-phenylethenyl]-1,3-dioxane
Chemidplus:0005420984