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About This Item
Linear Formula:
CH3(CH2)3CH(C2H5)CHO
CAS Number:
Molecular Weight:
128.21
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
204-596-5
Beilstein/REAXYS Number:
1700556
MDL number:
Assay:
96%
Form:
liquid
InChI key
LGYNIFWIKSEESD-UHFFFAOYSA-N
InChI
1S/C8H16O/c1-3-5-6-8(4-2)7-9/h7-8H,3-6H2,1-2H3
SMILES string
[H]C(=O)C(CC)CCCC
assay
96%
form
liquid
impurities
<4% 2-ethylhexanoic acid
Quality Level
bp
55 °C/13.5 mmHg (lit.)
density
0.822 g/mL at 25 °C (lit.)
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General description
2-Ethylhexanal is an aliphatic aldehyde used as an intermediate to produce various useful products such as perfumes, disinfectants, paints, warning agents, insecticides, and leak detectors.
Application
2-Ethylhexanal can be used as:
- A reductant in the Mukaiyama epoxidation of cis-cyclooctene.
- A reactant in the Horner-Wadsworth-Emmons reaction to synthesize cis-α,β-unsaturated amides.
- A starting material to synthesize 2-ethylhexanoic acid using manganese(II) acetate as a catalyst.
signalword
Warning
hcodes
Hazard Classifications
Flam. Liq. 3 - Repr. 2 - Skin Sens. 1
Storage Class
3 - Flammable liquids
wgk
WGK 1
flash_point_f
111.2 °F - closed cup
flash_point_c
44 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Regulatory Information
危险化学品
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G Casperson et al.
Journal of basic microbiology, 26(5), 259-269 (1986-01-01)
Analogs of the natural substance (E)-hex-2-en-1-al which occurs naturally in green plants and is known to have microbiocidal properties were synthesized and studied with respect to their antifungal properties. Saturated and unsaturated aldehydes, alcohols, carbon acids and enolacetate were tested
The effect of feeding di-(2-ethylhexyl) phthalate and related compounds on lipids in the laying hen.
D L Wood et al.
Poultry science, 63(3), 469-477 (1984-03-01)
Di-(2-ethylhexyl) phthalate (DEHP) and three structurally related side-chain analogs were fed to laying hens to determine relationships of structure to effects on lipid metabolism. Hubbard broiler breeder hens were fed either a standard laying mash control diet or the control
Factors affecting the selectivity of air oxidation of 2-ethyhexanal, an α-branched aliphatic aldehyde
Lehtinen C and Brunow G
Organic Process Research & Development, 4, 544-549 (2000)
Continuous catalytic ?one-pot? multi-step synthesis of 2-ethylhexanal from crotonaldehyde
Seki T, et al.
Chemical Communications (Cambridge, England), 3562-3564 (2007)
Heather L Voegtle et al.
Journal of chemical ecology, 34(2), 215-219 (2008-01-24)
E-2-ethyl-2-hexen-1-ol (1), mellein (4), and 4-hydroxymellein (5) were identified as the major volatile compounds in the head and/or thorax of Camponotus quadrisectus. Neither 1 nor 5 have been previously detected in insects. Also identified were small amounts of m-cresol (2)
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