Cas no 736991-91-6 ((1E)-1-(dimethylamino)-4,4-dimethoxypent-1-en-3-one)

(1E)-1-(Dimethylamino)-4,4-dimethoxypent-1-en-3-one is a versatile intermediate in organic synthesis, characterized by its α,β-unsaturated ketone structure and dimethylamino and dimethoxy functional groups. This compound is particularly valuable in the preparation of heterocyclic compounds and as a building block for pharmaceuticals and agrochemicals. Its conjugated system enhances reactivity in Michael additions and cyclization reactions, while the electron-donating dimethylamino group facilitates nucleophilic substitutions. The dimethoxy moiety further contributes to stability and solubility in polar solvents. This product is favored for its synthetic flexibility, enabling efficient modifications for targeted applications. Proper handling under inert conditions is recommended due to potential sensitivity to moisture and air.
(1E)-1-(dimethylamino)-4,4-dimethoxypent-1-en-3-one structure
736991-91-6 structure
Product Name:(1E)-1-(dimethylamino)-4,4-dimethoxypent-1-en-3-one
CAS No:736991-91-6
MF:C9H17NO3
MW:187.236182928085
MDL:MFCD18384851
CID:4787895
PubChem ID:5369141
Update Time:2025-06-15

(1E)-1-(dimethylamino)-4,4-dimethoxypent-1-en-3-one Chemical and Physical Properties

Names and Identifiers

    • (E)-1-Dimethylamino-4,4-dimethoxy-pent-1-en-3-one
    • (E)-1-(dimethylamino)-4,4-dimethoxypent-1-en-3-one
    • (1E)-1-(dimethylamino)-4,4-dimethoxypent-1-en-3-one
    • Propenone, 1-(1,1-dimethoxyethyl)-3-dimethylamino-
    • NE38207
    • (1E)-1-(Dimethylamino)-4,4-dimethoxy-1-penten-3-one #
    • MDL: MFCD18384851
    • Inchi: 1S/C9H17NO3/c1-9(12-4,13-5)8(11)6-7-10(2)3/h6-7H,1-5H3/b7-6+
    • InChI Key: OVRSIQWVIJSERH-VOTSOKGWSA-N
    • SMILES: O(C)C(C(/C=C/N(C)C)=O)(C)OC

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 5
  • Complexity: 195
  • XLogP3: 0.4
  • Topological Polar Surface Area: 38.8

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Additional information on (1E)-1-(dimethylamino)-4,4-dimethoxypent-1-en-3-one

Comprehensive Analysis of (1E)-1-(dimethylamino)-4,4-dimethoxypent-1-en-3-one (CAS No. 736991-91-6)

The compound (1E)-1-(dimethylamino)-4,4-dimethoxypent-1-en-3-one (CAS No. 736991-91-6) is a highly specialized organic molecule with significant applications in pharmaceutical and agrochemical research. Its unique structure, featuring a dimethylamino group and dimethoxy substituents, makes it a valuable intermediate in synthetic chemistry. Researchers are increasingly interested in this compound due to its potential role in developing novel bioactive molecules, aligning with the growing demand for sustainable and efficient chemical solutions.

In recent years, the search for innovative chemical intermediates has surged, driven by advancements in drug discovery and material science. (1E)-1-(dimethylamino)-4,4-dimethoxypent-1-en-3-one stands out as a versatile building block, particularly in the synthesis of heterocyclic compounds, which are pivotal in medicinal chemistry. Its enone moiety and electron-rich groups contribute to its reactivity, enabling diverse transformations under mild conditions. This aligns with the industry's shift toward greener and more atom-economical processes.

The compound's CAS No. 736991-91-6 is frequently queried in scientific databases, reflecting its relevance in academic and industrial settings. Users often search for "synthetic routes for (1E)-1-(dimethylamino)-4,4-dimethoxypent-1-en-3-one" or "applications of CAS 736991-91-6 in catalysis," highlighting its multidisciplinary appeal. Additionally, its stability and solubility properties make it a candidate for high-throughput screening platforms, a hot topic in modern drug development.

From an SEO perspective, integrating keywords like "dimethylamino pentenone derivatives" and "dimethoxy enone synthesis" can enhance visibility. The compound's potential in photocatalysis and bioconjugation also resonates with trending research themes, such as renewable energy and targeted drug delivery. By addressing these queries, this content bridges the gap between technical specificity and user intent, ensuring both readability and discoverability.

In conclusion, (1E)-1-(dimethylamino)-4,4-dimethoxypent-1-en-3-one (CAS No. 736991-91-6) exemplifies the intersection of innovation and practicality in organic chemistry. Its adaptability to emerging technologies and alignment with sustainability goals position it as a compound of enduring interest. Future studies may explore its structure-activity relationships or scalable production methods, further solidifying its role in scientific progress.

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