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Methyl octanoate

ALDRICH/W272809 - 99%, FG

Synonym: Caprylic acid methyl ester; Methyl caprylate

CAS Number: 111-11-5
Empirical Formula (Hill Notation): C9H18O2
Molecular Weight: 158.24
EC Number: 203-835-0
MDL Number: MFCD00009551
Linear Formula: CH3(CH2)6COOCH3
Product Type: Chemical
Catalog Number PKG Qty. Price Quantity
45-W272809-SAMPLE-K 1 each
 $56.30
1/EA		 Add To Favorites
45-W272809-1KG-K 1 kg
 $90.10
1/EA		 Add To Favorites
45-W272809-9KG-K 9 kg
 $0.00
1/EA
CALL FOR PRICE		 Add To Favorites

 

agency follows IFRA guidelines
  meets purity specifications of JECFA
application(s) flavors and fragrances
assay 99%
biological source synthetic
bp 194-195 °C (lit.)
density 0.877 g/mL at 25 °C (lit.)
documentation see Safety & Documentation for available documents
food allergen no known allergens
fragrance allergen no known allergens
grade FG
  Fragrance grade
  Halal
  Kosher
InChI 1S/C9H18O2/c1-3-4-5-6-7-8-9(10)11-2/h3-8H2,1-2H3
InChI key JGHZJRVDZXSNKQ-UHFFFAOYSA-N
organoleptic green; fruity; citrus; sweet
Quality Level 300 
  400 
refractive index n20/D 1.417 (lit.)
reg. compliance EU Regulation 1223/2009
  EU Regulation 1334/2008 & 872/2012
  FDA 21 CFR 172.515
SMILES string CCCCCCCC(=O)OC
Application:

  • Efficient identification of raw and ripe tung oil using headspace GC-MS.: This research demonstrates the use of headspace gas chromatography-mass spectrometry for identifying components, including methyl octanoate, in tung oil. The method offers applications in quality control and authentication of oil products (Xu et al., 2021 ).

  • Chemical kinetic study of the oxidation of a biodiesel-bioethanol surrogate fuel: methyl octanoate-ethanol mixtures.: The paper investigates the oxidation kinetics of methyl octanoate and ethanol mixtures, providing insights into their use as biofuels. This study is significant for the development of renewable energy sources (Togbe et al., 2010 ).
General description: Methyl octanoate has been identified in the volatile flavor fractions of blue cheese and soursop.
Packaging: 1 kg in poly bottle
Packaging: 9 kg in poly drum
WGK Germany WGK 1
Flash Point(F) 179.6 °F - closed cup
Flash Point(C) 82 °C - closed cup
Purity 99%
bp 194-195 °C (lit.)
Density 0.877 g/mL at 25 °C (lit.)
Refractive Index n20/D 1.417 (lit.)
FEMA Number 2728
UNSPSC 12164502

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