IUPAC name Ethyl hexanoate. Caproic acid ethyl ester. Answer: ethyl 3-bromopentanoate. Ethyl hexanoate. PubMed: Tracer aroma compound transfer from a solid and complex-flavored food matrix packed in treated papers or plastic packaging film. EPA Registry Name: Mercuric 2-ethyl hexanoate. 3. ethyl 4-cyclobutyl-2-methyloctanoate. Recommendation for ethyl 3,5,5-trimethyl hexanoate usage levels up to: 5.0000 % in the fragrance concentrate. Ethyl Caproate-d11; ETHYL HEXANOATE-D11; IUPAC Name. Methyl hexanoate is a fatty acid methyl ester derived from hexanoic (caproic acid).It has a role as a plant metabolite and a flavouring agent. Ethyl-hexanoat -zink (1:1) [German] [ACD/IUPAC Name] Hexanoate d'éthyle - zinc (1:1) [French] [ACD/IUPAC Name] Hexanoic acid, ethyl ester, zinc salt (1:1) [ACD/Index Name] zinc 2-ethyl hexanoate. InChIKey. In both common and International Union of Pure and Applied Chemistry (IUPAC) nomenclature, the - ic ending of the parent acid is replaced by the suffix - ate (Table \(\PageIndex{1}\)). Systematic Name: Hexanoic acid, ethyl ester CAS Number: 123-66-0. It has a pleasant pineapple smell. 2. methyl 6-cyclobutyl-2-methyloctanoate. c) dimethypropyllamine. Ethyl hexanoate is the ester resulting from the condensation of hexanoic acid and ethanol. InChI=1S/C8H16O2/c1-3-5-6-7-8(9)10-4-2/h 3-7H2,1-2H3 Copy. Molecular Weight: 144.21 Molecular Formula: C8H16O2 ... *Disclaimer: The IUPAC, INCHI, and SMILES data on this page has its source from CompTox. Other names Ethyl caproate Caproic acid ethyl ester. Molecular Weight: 244.51 Molecular Formula: C8H16O2.1/2Hg Additional Metadata. EMAIL INQUIRY to 1 to 30 of 36 Sodium 2-Ethyl Hexanoate (CAS No. The group name of the alkyl or aryl portion is given first and is followed by the name of the acid portion. Isotopologues: ethyl hexanoate-d11 Structure. Ethyl hexanoate is a very hydrophobic molecule, practically insoluble (in water), and relatively neutral. In both common and International Union of Pure and Applied Chemistry (IUPAC) nomenclature, the – ic ending of the parent acid is replaced by the suffix – ate ( Table 15.3 “Nomenclature of Esters” ). Predicted - ACD/Labs. Ethyl hexanoate | C8H16O2 | CID 31265 - structure, chemical names, physical and chemical properties, classification, patents, literature, biological activities, safety/hazards/toxicity information, … Other names Ethyl caproate Caproic acid ethyl ester. Methyl hexanoate is the fatty acid methyl ester of hexanoic acid (caproic acid), a colourless liquid organic compound with the chemical formula CH. Ethyl hexanoate, also known as ethyl caproate or ethyl hexoic acid, belongs to the class of organic compounds known as fatty acid esters. ACM2159195. Ethyl hexanoate; Names; Preferred IUPAC name. CCCCCC(=O)OCC Copy. CAS: 123-66-0: Molecular Formula: C 8 H 16 O 2: Molecular Weight (g/mol) 144.21: MDL Number: MFCD00009511: InChI Key: SHZIWNPUGXLXDT-UHFFFAOYSA-N: Synonym: ethyl caproate,ethyl hexoate,hexanoic acid, ethyl ester,hexanoic acid ethyl ester,capronic ether absolute,caproic acid ethyl ester,ethyl n-hexanoate,ethyl butyl acetate,caproate,acetic acid, butyl-, ethyl ester An IUPAC name is based on the international standard chemical nomenclature set by the International Union of Pure and Applied Chemistry (IUPAC). b) dimethylpentanamine. It can also be found in the cytoplasm of cells. a) octanoic acid b) 6-ethyl-4-methylhexanoic acid c) 4,6-dimethyloctanoic acid d) 3,5-dimethyloctanoic acid . Ethyl caproate Caproic acid ethyl ester. Malden: Blackwell Science, 1998. ChEBI. Identifiers CAS Number. Reference substance name: Ethyl hexanoate EC Number: 204-640-3 EC Name: Ethyl hexanoate CAS Number: 123-66-0 Molecular formula: C8H16O2 IUPAC Name: ethyl hexanoate Molecular Weight: 202.25 Molecular Formula: C10H18O4 Additional Metadata. IUPAC Standard InChIKey: SHZIWNPUGXLXDT-UHFFFAOYSA-N; CAS Registry Number: 123-66-0; Chemical structure: This structure is also available as a 2d Mol file or as a computed 3d SD file The 3d structure may be viewed using Java or Javascript. ... Ethyl hexanoate is the ester resulting from the condensation of hexanoic acid and ethanol. 17) Provide the IUPAC name for the following organic compound. Heterocyclic Organic Compound. InChi. b) methylbutanamine. Ethyl hexanoate Names Preferred IUPAC name. What is the IUPAC name for the following compound? IUPAC Name: ethyl 3-cyano-5-methylhexanoate . Recommendation for ethyl 3,5,5-trimethyl hexanoate flavor usage levels up … In both common and International Union of Pure and Applied Chemistry (IUPAC) nomenclature, the - ic ending of the parent acid is replaced by the suffix - ate ( Table 15.3 "Nomenclature of Esters" ). It may be used in the synthesis of ethyl 6-(trifluoromethylsulfony loxy)hexanoate. These are carboxylic ester derivatives of a fatty acid. Systematic name. It may be used in the preparation of alkyl triflates. Std. R = Peer reviewed scientific publications, A = Chromosome aberration (EFSA database), E = Unspecified genotoxicity type (miscellaneous data source), 2-diethylaminoethyl hexanoate (Ref: DA-6). 2) What is the IUPAC name of the molecule below? ... ethyl hexanoate. 2159-19-5. The group name of the alkyl or aryl portion is given first and is followed by the name of the acid portion. Fruit including strawberry; Field crops including vegetables such as pakchoi, spinach; Rice; Ornamentals; Turfgrass, EC Regulation 1107/2009 (repealing 91/414), Approved for use (✓) or known to be used (#) in the following EU-27 Member States, International Chemical Identifier key (InChIKey), International Chemical Identifier (InChI), InChI=1/C12H25NO2/c1-4-7-8-9-12(14)15-11-10-13(5-2)6-3/h4-11H2,1-3H3, hexanoic acid, 2-(diethylamino)ethyl ester, Relevant Environmental Water Quality Standards, Herbicide Resistance Classification (HRAC), Herbicide Resistance Classification (WSSA), Insecticide Resistance Classification (IRAC), Fungicide Resistance Classification (FRAC), White to yellow coloured powdery solid with slight greasy feel, Example manufacturers & suppliers of products using this active now or historically, No UK approval for use as a pesticide under EC Regulation 1107/2009, Source; quality score; and other information, Solubility - In organic solvents at 20 °C (mg l⁻¹), Octanol-water partition coefficient at pH 7, 20 °C, Henry's law constant at 25 °C (Pa m³ mol⁻¹), Dissipation rate RL₅₀ on and in plant matrix, Published literature Rl50 range 0.6-6.8 days, leaves of 3 field crops, n=4, Aqueous hydrolysis DT₅₀ (days) at 20 °C and pH 7, SCI-GROW groundwater index (μg l⁻¹) for a 1 kg ha⁻¹ or 1 l ha⁻¹ application rate, Potential for particle bound transport index, Mammals - Chronic 21d NOAEL (mg kg⁻¹ bw d⁻¹), Birds - Chronic 21d NOEL (mg kg⁻¹ bw d⁻¹), Aquatic invertebrates - Acute 48 hour EC₅₀ (mg l⁻¹), Aquatic invertebrates - Chronic 21 day NOEC (mg l⁻¹), Aquatic crustaceans - Acute 96 hour LC₅₀ (mg l⁻¹), Sediment dwelling organisms - Acute 96 hour LC₅₀ (mg l⁻¹), Sediment dwelling organisms - Chronic 28 day NOEC, static, water (mg l⁻¹), Sediment dwelling organisms - Chronic 28 day NOEC, sediment (mg kg⁻¹), Aquatic plants - Acute 7 day EC₅₀, biomass (mg l⁻¹), Algae - Acute 72 hour EC₅₀, growth (mg l⁻¹), Algae - Chronic 96 hour NOEC, growth (mg l⁻¹), Contact acute LD₅₀ (worst case from 24, 48 and 72 hour values - μg bee⁻¹), Oral acute LD₅₀ (worst case from 24, 48 and 72 hour values - μg bee⁻¹), Unknown mode acute LD₅₀ (worst case from 24, 48 and 72 hour values - μg bee⁻¹), Acute LD₅₀ (worst case from 24, 48 and 72 hour values - μg insect⁻¹), Earthworms - Chronic NOEC, reproduction (mg kg⁻¹), Threshold of Toxicological Concern (Cramer Class), Mammals - Dermal LD₅₀ (mg kg⁻¹ body weight), ADI - Acceptable Daily Intake (mg kg⁻¹ bw day⁻¹), ARfD - Acute Reference Dose (mg kg⁻¹ bw day⁻¹), AAOEL - Acute Acceptable Operator Exposure Level (mg kg⁻¹ bw day⁻¹), AOEL - Acceptable Operator Exposure Level - Systemic (mg kg⁻¹ bw day⁻¹), May generate explosive and toxic gases when heated to decomposition. 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