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2-Ethylhexanol

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CAS:104-76-7
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2-Ethylhexanol manufacturers

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  • 2024-11-25
  • CAS:104-76-7
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  • 2-Ethyl Hexanol
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  • $6.00 / 1kg
  • 2024-11-25
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2-Ethylhexanol Basic information
Product Name:2-Ethylhexanol
Synonyms:ETHYL-1-HEXANOL, 2-;'ISOOCTYL ALCOHOL';1-ETHYL-N-AMYLCARBINOL;2-ETHYLHEXANOL;2-ethvlhexanol;2-ethyl2-hexan-1-o1;2-ethylhexan-;2-ethylhexanol(flammableliquids,n.o.s.)
CAS:104-76-7
MF:C8H18O
MW:130.23
EINECS:203-234-3
Product Categories:Industrial/Fine Chemicals;Alcohols;Building Blocks;C7 to C8;Chemical Synthesis;Organic Building Blocks;Oxygen Compounds;104-76-7;a versatile solvent. as a chain terminator in synthesizing condensation polymers and as an intermediate for plasticizers
Mol File:104-76-7.mol
2-Ethylhexanol Structure
2-Ethylhexanol Chemical Properties
Melting point −76 °C(lit.)
Boiling point 183-186 °C(lit.)
density 0.833 g/mL at 25 °C(lit.)
vapor density 4.49 (vs air)
vapor pressure 0.2 mm Hg ( 20 °C)
FEMA 3151 | 2-ETHYL-1-HEXANOL
refractive index n20/D 1.431(lit.)
Fp 171 °F
storage temp. Store below +30°C.
solubility Water
pka15.05±0.10(Predicted)
form Liquid
color Clear
PH7 (1g/l, H2O, 20℃)
Odorsweet.
Odor Threshold0.013ppm
explosive limit0.88%, 104°F
Odor Typecitrus
Water Solubility 1 g/L (20 ºC)
JECFA Number267
Merck 14,3808
BRN 1719280
Dielectric constant3.4(18℃)
Stability:Stable. Combustible. Incompatible with strong oxidizing agents, strong acids.
InChIKeyYIWUKEYIRIRTPP-UHFFFAOYSA-N
LogP2.9 at 25℃
CAS DataBase Reference104-76-7(CAS DataBase Reference)
NIST Chemistry Reference1-Hexanol, 2-ethyl-(104-76-7)
EPA Substance Registry System2-Ethylhexanol (104-76-7)
Safety Information
Hazard Codes Xn,Xi
Risk Statements 37/38-41-36-21-52/53-36/37/38-20
Safety Statements 26-36/39-36/37/39-36-61
WGK Germany 2
RTECS MP0350000
Autoignition Temperature550 °F
TSCA Yes
HS Code 29051610
HS Code 29339990
Hazardous Substances Data104-76-7(Hazardous Substances Data)
ToxicityLD50 orally in Rabbit: 3730 mg/kg LD50 dermal Rat > 3000 mg/kg
MSDS Information
ProviderLanguage
2-Ethyl-1-hexanol English
SigmaAldrich English
ACROS English
ALFA English
2-Ethylhexanol Usage And Synthesis
Chemical Properties2-Ethylhexanol is a clear, colorless to pale yellow oily liquid. It has a mild, oily, sweet, slightly floral odor reminiscent of rose and sweet, fatty-floral taste with a fruity note. Soluble in 720 times water, miscible in most organic solvents.
OccurrenceReported found in papaya, peach, pear, blackberry, strawberry, cabbage, Parmesan and mozzarella cheese, butter, roasted chicken, cognac, sherry, grape wines, tea, avocado, kiwifruit, crab and clam.
Uses2-Ethylhexanol is the most important C8 alcohol and is mainly used as the alcohol component for the manufacture of ester plasticizers for soft poly(vinyl chloride) (PVC). Other minor uses include the manufacturing of 2-ethylhexyl acrylate, as a dispersing agent and wetting agent, as a solvent for gums and resins, as a cosolvent for nitrocellulose, and in ceramics, paper coatings, rubber latex, textiles, and fragrances.
Uses2-Ethyl-1-hexanol is used as a flavor, fragrance and plasticizer. It is used to prepare diesters bis(2-ethylhexyl) phthalate. It reacts with nitric acid and used as an octane booster. Its ester, 2-ethylhexyl ester is a component of sunscreen octocrylene. Further, it is used as a low volatility solvent for resins, animal fats, waxes, vegetable oils and petroleum derivatives. In addition to this, it is used in plasticizer, dioctyl phthalate, which is used in the production of polyvinyl chloride products.
Preparation2-ethylhexanol synthesis: Condensation of acetaldehyde into butanol aldehyde, dehydration to obtain crotonaldehyde, hydrogenation to n-butyraldehyde, condensation dehydration to obtain 2-ethyl-2-hexenal, and then hydrogenation to obtain 2-ethylhexanol.
Application2-Ethyl-1-hexanol is suitable for use in a study to compare its susceptibilities of dynamic heat capacity and dielectric polarization under isothermal conditions. It may be used to study lipase-catalyzed transesterification (alcoholysis) of rapeseed oil and 2-ethyl-1-hexanol in the absence of solvent. 2-Ethyl-1-hexanol may be used in broadband dielectric spectroscopy studies of the polyalcohols-glycerol, xylitol and sorbitol. It may be used in the preparation of porous beads.
DefinitionChEBI: 2-Ethylhexanol is a primary alcohol that is hexan-1-ol substituted by an ethyl group at position 2. It has a role as a volatile oil component and a plant metabolite.
General Description2-ethyl hexanol appears as a dark brown liquid with an aromatic odor. Insoluble in water and less dense than water. Flash point between 140 - 175°F. Contact may irritate skin, eyes and mucous membranes. May be toxic by ingestion, inhalation and skin absorption.
Air & Water ReactionsInsoluble in water.
Reactivity Profile2-Ethylhexanol is an alcohol. Flammable and/or toxic gases are generated by the combination of alcohols with alkali metals, nitrides, and strong reducing agents. They react with oxoacids and carboxylic acids to form esters plus water. Oxidizing agents convert them to aldehydes or ketones. Alcohols exhibit both weak acid and weak base behavior. They may initiate the polymerization of isocyanates and epoxides. 2-Ethylhexanol is incompatible with strong oxidizing agents and strong acids.
Health HazardAnesthesia, nausea, headache, dizziness; mildly irritating to skin and eyes.
Fire Hazard2-Ethylhexanol is combustible.
Safety ProfileModerately toxic by ingestion, skin contact, intraperitoneal, subcutaneous, and parented routes. An experimental teratogen. Other experimental reproductive effects. A severe eye and moderate skin irritant. Mutation data reported. A dangerous fire hazard when ex posed to heat or flame; can react vigorously with oxidzing materials. To fight fire, use foam, CO2, dry chemical. When heated to decomposition it emits acrid smoke and fumes. See also ALCOHOLS.
SynthesisBy hydrogenation of aldehydes obtained by the oxo process; also synthesized from propylene; by catalytic reduction of 2-ethyl-2-hexenal and other similar patented processes.
CarcinogenicityMale and female F344 rats were dosed by oral gavage with 0, 50, 150, or 500 mg/kg 2-ethylhexanol (0.005% in aqueous Cremophor EL, a polyoxyl 35 castor oil), 5 days/week for 2 years. There were no differences of biological importance between the vehicle control and a water control group that was included in the study. There was no evidence of treatment-related neoplastic lesions in any of the exposed groups.
Tag:2-Ethylhexanol(104-76-7) Related Product Information
Sodium 2-ethylhexanoate 2,2,4-Trimethylpentane Isovaleric acid Potassium 2-ethylhexanoate Diethylene Glycol Monoethyl Ether Ethyl acetate ISOXADIFEN-ETHYL Trinexapac-ethyl 2-Ethoxyethanol Ethylparaben 2-ETHYLHEXANAL 2-Ethylhexanoic acid 1-Hexanol Ethylhexyl Palmitate Ethanol 2-Ethylhexylamine Hexaconazole Cobalt bis(2-ethylhexanoate)