Cas no 127818-58-0 (3-Methyl-5-nitrophenol)

3-Methyl-5-nitrophenol structure
3-Methyl-5-nitrophenol structure
Product Name:3-Methyl-5-nitrophenol
CAS No:127818-58-0
MF:C7H7NO3
MW:153.135381937027
MDL:MFCD09038591
CID:63897
PubChem ID:237552
Update Time:2025-04-18

3-Methyl-5-nitrophenol Chemical and Physical Properties

Names and Identifiers

    • 3-Methyl-5-nitrophenol
    • Phenol,3-Methyl-5-nitro-
    • 3-Methyl-5-nitro phenol
    • Phenol, 3-methyl-5-nitro-
    • NSC41202
    • 5-Nitro-3-methylphenol
    • KDKCEPVMXOUFJD-UHFFFAOYSA-N
    • FCH865295
    • RP21701
    • AB0035386
    • ST2405138
    • AX8088108
    • X9708
    • S-6
    • DTXSID20285256
    • FT-0702183
    • MFCD09038591
    • AC-5207
    • NSC-41202
    • GS-0940
    • AKOS006330403
    • 3-Methyl-5-nitro-phenol
    • SCHEMBL5201173
    • CS-0028791
    • J-512874
    • A19937
    • 127818-58-0
    • SY107669
    • DB-062613
    • MDL: MFCD09038591
    • Inchi: 1S/C7H7NO3/c1-5-2-6(8(10)11)4-7(9)3-5/h2-4,9H,1H3
    • InChI Key: KDKCEPVMXOUFJD-UHFFFAOYSA-N
    • SMILES: OC1C=C(C=C(C)C=1)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 153.04300
  • Monoisotopic Mass: 153.043
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 154
  • 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
  • Topological Polar Surface Area: 66
  • XLogP3: 1.8

Experimental Properties

  • Color/Form: No data available
  • Density: 1.3±0.1 g/cm3
  • Melting Point: No data available
  • Boiling Point: 295.7°C at 760 mmHg
  • Flash Point: 135.4±12.5 °C
  • Refractive Index: 1.596
  • PSA: 66.05000
  • LogP: 2.13200

3-Methyl-5-nitrophenol Security Information

3-Methyl-5-nitrophenol Customs Data

  • HS CODE:2908999090
  • Customs Data:

    China Customs Code:

    2908999090

    Overview:

    2908999090 Halogenated derivatives of other phenols and phenolic alcohols(Including its sulfonation\Nitrosative or nitrosative derivatives). VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:5.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2908999090 halogenated, sulphonated, nitrated or nitrosated derivatives of phenols or phenol-alcohols.Supervision conditions:None.VAT:17.0%.Tax rebate rate:9.0%.MFN tariff:5.5%.General tariff:30.0%

3-Methyl-5-nitrophenol Pricemore >>

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3-Methyl-5-nitrophenol Related Literature

  • 1. Electrophilic aromatic substitution. Part 23. The nitration of phenol and the cresols in aqueous sulphuric acid
    Robert G. Coombes,John G. Golding,Panicos Hadjigeorgiou J. Chem. Soc. Perkin Trans. 2 1979 1451
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