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About This Item
Linear Formula:
(C2H5)2CHCHO
CAS Number:
Molecular Weight:
100.16
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
202-623-5
Beilstein/REAXYS Number:
1209330
MDL number:
Assay:
≥92%
refractive index
n20/D 1.402 (lit.)
bp
117 °C (lit.)
density
0.814 g/mL at 25 °C (lit.)
functional group
aldehyde
InChI key
UNNGUFMVYQJGTD-UHFFFAOYSA-N
InChI
1S/C6H12O/c1-3-6(4-2)5-7/h5-6H,3-4H2,1-2H3
SMILES string
CCC(CC)C=O
assay
≥92%
Quality Level
Related Categories
General description
2-Ethylbutyraldehyde reacts with cyclohexanecarbaldehyde to form homoallylic alcohols.
Application
2-Ethylbutyraldehyde has been used in the preparation of aldoximes using aqueous hydroxylamine.
signalword
Danger
hcodes
Hazard Classifications
Eye Irrit. 2 - Flam. Liq. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
3 - Flammable liquids
wgk
WGK 1
flash_point_f
69.8 °F - closed cup
flash_point_c
21 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Regulatory Information
危险化学品
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Highly diastereoselective reactions using masked allylic zinc reagents.
Jones P and Knochel P.
Chemical Communications (Cambridge, England), 21, 2407-2408 (1998)
Controlling Selectivity in the Consecutive Reaction Network of Aldoxime Hydrogenation to Primary Amines.
Gebauer-Henke E, et al. et al.
Synthesis, 102 null
Noa T Sorbara et al.
Organic & biomolecular chemistry, 17(37), 8618-8627 (2019-09-19)
A rational approach that may be applied to a broad class of enzyme-catalyzed reactions to design enzyme inhibitors affords a powerful strategy, facilitating the development of drugs and/or molecular probes of enzyme mechanisms. A strategy for the development of substrate-product
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Amino acid derivative reactivity assay (ADRA) has previously been developed as an alternative method to direct peptide reactivity assay (DPRA) to evaluate key event 1 in skin sensitization mechanisms. However, when using alternative methods for skin sensitization, integrated approaches to
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