Cas no 29604-25-9 (4-Chloro-2-ethoxy-1-nitrobenzene)

4-Chloro-2-ethoxy-1-nitrobenzene is a nitro-substituted aromatic compound featuring both chloro and ethoxy functional groups. Its molecular structure (C8H8ClNO3) lends utility as an intermediate in organic synthesis, particularly in the production of dyes, pharmaceuticals, and agrochemicals. The presence of electron-withdrawing (nitro) and electron-donating (ethoxy) groups enhances its reactivity in electrophilic and nucleophilic substitution reactions. The chloro group further facilitates derivatization, making it valuable for constructing complex molecules. This compound is characterized by moderate stability under standard conditions, though storage in a cool, dry environment is recommended to prevent decomposition. Its well-defined reactivity profile and functional group compatibility make it a versatile building block in fine chemical synthesis.
4-Chloro-2-ethoxy-1-nitrobenzene structure
29604-25-9 structure
Product Name:4-Chloro-2-ethoxy-1-nitrobenzene
CAS No:29604-25-9
MF:C8H8ClNO3
MW:201.607021331787
MDL:MFCD02625956
CID:252182
PubChem ID:675064
Update Time:2025-10-29

4-Chloro-2-ethoxy-1-nitrobenzene Chemical and Physical Properties

Names and Identifiers

    • 4-Chloro-2-ethoxy-1-nitrobenzene
    • Benzene,4-chloro-2-ethoxy-1-nitro-
    • 3-ethoxy-4-nitro-chlorobenzene
    • 4-Chloro-2-Ethoxy-1-Nitro-Benzene
    • 4-Chloro-2-ethoxynitrobenzene
    • 5-Chlor-2-nitro-1-aethoxy-benzol
    • 5-Chlor-2-nitro-phenetol
    • 5-Chloro-2-nitrophenetole
    • DTXSID50350168
    • SCHEMBL316689
    • AKOS000424176
    • YYQSMJVVERBZPU-UHFFFAOYSA-N
    • BS-22247
    • 29604-25-9
    • Benzene, 4-chloro-2-ethoxy-1-nitro-
    • SR-01000533257
    • SR-01000533257-1
    • CS-0450641
    • MFCD02625956
    • G73693
    • STK000410
    • MDL: MFCD02625956
    • Inchi: 1S/C8H8ClNO3/c1-2-13-8-5-6(9)3-4-7(8)10(11)12/h3-5H,2H2,1H3
    • InChI Key: YYQSMJVVERBZPU-UHFFFAOYSA-N
    • SMILES: ClC1C=CC(=C(C=1)OCC)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 201.01900
  • Monoisotopic Mass: 201.0192708g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 183
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.8
  • Topological Polar Surface Area: 55?2

Experimental Properties

  • Density: 1.311
  • Melting Point: 52-54
  • Boiling Point: 302.3°Cat760mmHg
  • Flash Point: 136.6°C
  • Refractive Index: 1.55
  • PSA: 55.05000
  • LogP: 3.17010

4-Chloro-2-ethoxy-1-nitrobenzene Security Information

  • Hazard Statement: Irritant/Keep Cold
  • Hazardous Material Identification: Xi
  • Storage Condition:Keep cold

4-Chloro-2-ethoxy-1-nitrobenzene Customs Data

  • HS CODE:2909309090
  • Customs Data:

    China Customs Code:

    2909309090

    Overview:

    2909309090 Other aromatic ethers and their halogenated derivatives\sulfonation\Nitrated derivative(Including nitrosative derivatives).Regulatory conditions:nothing.VAT:17.0%.Tax refund rate:9.0%.MFN tariff:5.5%.general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2909309090 other aromatic ethers and their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

4-Chloro-2-ethoxy-1-nitrobenzene Pricemore >>

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4-Chloro-2-ethoxy-1-nitrobenzene Production Method

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