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methyl (E)-3-nonenoate

Chemical Structure

General Material Information

Preferred name methyl (E)-3-nonenoate
Trivial Name Methyl (3E)-3-nonenoate
Short Description methyl trans-3-nonenoate
Formula C10 H18 O2
CAS Number 36781-67-6
FDA UNII YU6W67I34W
Nikkaji Number J2.167.893G
MDL MFCD00065419
xLogP3-AA 3.20 (est)
NMR Predictor External link
Synonyms
  • methyl (3E)-non-3-enoate
  • methyl (E)-non-3-enoate
  • methyl trans-3-nonenoate
  • methyl trans-non-3-enoate
  • trans- nonenoic acid methyl ester
  • 3-nonenoic acid, methyl ester, (3E)-
  • 3-Nonenoic acid, methyl ester, (3E)-
  • 3-Nonenoic acid, methyl ester, (E)-
  • Methyl (3E)-3-nonenoate
  • trans-Methyl 3-nonenoate

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:2916.19.6000
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 170.25186157227
Vapor Pressure 0.171 mmHg @ 25 °C
Flash Point TCC Value 90.56 °C TCC
logP (o/w) 3.653 est
Solubility
alcohol Yes
water, 52.1 mg/L @ 25 °C (est) Yes
water No

Organoleptic Properties

Odor Type: Fruity
fruity, green, watermelon, pear
Odor strength medium
Substantivity > 24 hour(s) at 100.00 %
General comment At 100.00 %. fruity green watermelon pear
Flavor Type: Fruity
sweet, fresh, apple, melon
General comment Sweet fresh apple melon
Melon, apple, and other fruit flavors including tropical varieties. Sweet, fresh apple, melon notes

Potential Uses

Applications
Odor purposes Fruit, Melon
Flavoring purposes Coconut, Green, Mango, Peach, Pear, Strawberry

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:
flavoring agents
Recommendation for methyl (E)-3-nonenoate usage levels up to:
not for fragrance use.
Recommendation for methyl (E)-3-nonenoate flavor usage levels up to:
30.0000 ppm in the finished product.

Safety references

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):36781-67-6
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :5366844
National Institute of Allergy and Infectious Diseases:Data
methyl (E)-non-3-enoate
Chemidplus:0036781676