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allyl benzoate

Chemical Structure

General Material Information

Preferred name allyl benzoate
Trivial Name Allyl benzoate
Short Description 2-propenyl benzoate
Formula C10 H10 O2
CAS Number 583-04-0
ECHA Number 209-494-4
FDA UNII AQY5543KFE
Nikkaji Number J95.036J
MDL MFCD00026104
Bio Activity Summary External link
NMR Predictor External link
Synonyms
  • benzoic acid 2-propenyl ester
  • benzoic acid allyl ester
  • benzoic acid, 2-propen-1-yl ester
  • prop-2-en-1-yl benzoate
  • prop-2-enyl benzoate
  • 2-propenyl benzoate
  • Benzoic acid, allyl ester
  • Benzoic acid, 2-propenyl ester
  • 2-Propenyl benzoate
  • Allyl alcohol, benzoate
  • Monoallyl benzoate
  • NSC 32639
  • NSC 406846

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):HMDB40592
FooDB:FDB020375
Export Tariff Code:2916.31.5000
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 162.18809509277
Specific gravity @ 20 °C
Pounds per Gallon 8.764 to 8.797
Refractive Index 1.516 to 1.519 @ 20 °C
Boiling Point 82 to 85°C @ 5 mm Hg
Vapor Pressure 0.033 mmHg @ 25 °C
Flash Point TCC Value 100 °C TCC
logP (o/w) 3.024 est
Solubility
alcohol Yes
water, 348.1 mg/L @ 25 °C (est) Yes
water No

Organoleptic Properties

Odor Type: Fruity
sweet, floral, cherry, berry
General comment At 100.00 %. sweet floral cherry berry
Flavor Type: Fruity
banana
General comment Banana like

Occurrences

Potential Uses

Applications
Odor purposes Banana, Berry, Cherry

Safety Information

Safety information

Preferred SDS: View
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:
fragrance agents
RIFM Fragrance Material Safety Assessment: Search
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
IFRA Purity Specification:
Recommendation for allyl benzoate usage levels up to:
2.0000 % in the fragrance concentrate.
Recommendation for allyl benzoate flavor usage levels up to:
not for flavor use.

Safety references

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :11406
National Institute of Allergy and Infectious Diseases:Data
prop-2-enyl benzoate
Chemidplus:0000583040