Cas no 52661-56-0 ((E)-3-(5-Nitrofuran-2-yl)acrylaldehyde)

(E)-3-(5-Nitrofuran-2-yl)acrylaldehyde is a nitrofuran-based unsaturated aldehyde with significant utility in organic synthesis and pharmaceutical research. Its conjugated system, featuring both a nitro-substituted furan ring and an acrylaldehyde moiety, makes it a versatile intermediate for constructing heterocyclic compounds and bioactive molecules. The electron-withdrawing nitro group enhances reactivity, facilitating nucleophilic additions and cyclization reactions. This compound is particularly valuable in the development of antimicrobial and antiparasitic agents due to the inherent bioactivity of the nitrofuran scaffold. Its well-defined structure and synthetic accessibility ensure consistent performance in research applications, making it a reliable choice for medicinal chemistry and material science studies.
(E)-3-(5-Nitrofuran-2-yl)acrylaldehyde structure
52661-56-0 structure
Product Name:(E)-3-(5-Nitrofuran-2-yl)acrylaldehyde
CAS No:52661-56-0
MF:C7H5NO4
MW:167.118901968002
MDL:MFCD00009762
CID:378174
PubChem ID:5462962
Update Time:2025-05-27

(E)-3-(5-Nitrofuran-2-yl)acrylaldehyde Chemical and Physical Properties

Names and Identifiers

    • (2E)-3-(5-nitro-2-furanyl)-2-Propenal
    • (E)-3-(5-Nitro-2-furyl)acrylaldehyde
    • (E)-3-(5-Nitrofuran-2-yl)acrylaldehyde
    • 2-Propenal,3-(5-nitro-2-furanyl)-, (2E)-
    • 3-(5-NITRO-2-FURYL)ACROLEIN
    • 5-Nitrofuran-2-acrylaldehyde
    • 5-Nitro-2-furanacrolein
    • 5-Nitro-2-furylacrolein
    • 5-Nitrofuryl-2-acrolein
    • 2-Propenal, 3-(5-nitro-2-furanyl)-
    • 2-FURANACROLEIN, 5-NITRO-
    • 3-(5-Nitrofuran-2-yl)acrylaldehyde
    • (E)-3-(5-nitrofuran-2-yl)prop-2-enal
    • (2E)-3-(5-nitrofuran-2-yl)prop-2-enal
    • 3-(5-Nitro-2-furyl)-2-propenal
    • 3-(5-nitrofuran-2-y
    • 52661-56-0
    • 3-(5-nitrofuran-2-yl)prop-2-enal
    • AMY7195
    • NS00046615
    • A870937
    • MFCD00009762
    • 4-17-00-04700 (Beilstein Handbook Reference)
    • 1874-22-2
    • CCA66156
    • AKOS005131446
    • J-517869
    • EINECS 258-078-9
    • EN300-7406673
    • DTXSID101031099
    • EINECS 217-499-8
    • CCRIS 1541
    • EN300-1855745
    • CS-0158506
    • DXWCZMGIIFEEPU-OWOJBTEDSA-N
    • (E)?-?3-?(5-?Nitrofuran-?2-?yl)?acrylaldehyde
    • Z1255395044
    • D70748
    • CHEMBL164282
    • (E)-3-(5-nitro-furan-2-yl)-acrylaldehyde
    • STR05391
    • A813150
    • (E)-3-(5-nitro-2-furyl)prop-2-enal
    • BRN 0005494
    • BBL023121
    • STL284487
    • DB-247222
    • (2E)-3-(5-Nitro-2-furanyl)-2-propenal; (2E)-3-(5-nitro-2-furanyl)-2-propenal; (E)-3-(5-Nitro-2-furyl)acrolein; trans-3-(5-Nitro-2-furyl)acrolein;
    • MDL： MFCD00009762
    • Inchi： 1S/C7H5NO4/c9-5-1-2-6-3-4-7(12-6)8(10)11/h1-5H/b2-1+
    • InChI Key： DXWCZMGIIFEEPU-OWOJBTEDSA-N
    • SMILES： O1C(=CC=C1/C=C/C=O)[N+](=O)[O-]
    • BRN： 0005494

Computed Properties

  • Exact Mass: 167.02185
  • Monoisotopic Mass: 167.022
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 208
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1
  • Topological Polar Surface Area: 76
  • Surface Charge: 0
  • Tautomer Count: nothing

Experimental Properties

  • Color/Form: No data avaiable
  • Density: 1.4±0.1 g/cm3
  • Melting Point: No data available
  • Boiling Point: 310.7±32.0°C at 760 mmHg
  • Flash Point: 141.7±25.1 °C
  • Refractive Index: 1.587
  • PSA: 73.35
  • LogP: 1.92310
  • Vapor Pressure: No data available

(E)-3-(5-Nitrofuran-2-yl)acrylaldehyde Security Information

(E)-3-(5-Nitrofuran-2-yl)acrylaldehyde Pricemore >>

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