Cas no 41833-13-0 (4-Hydroxy-3-nitrobenzyl alcohol)

4-Hydroxy-3-nitrobenzyl alcohol is a nitro-substituted benzyl alcohol derivative with the molecular formula C?H?NO?. This compound features both hydroxyl and nitro functional groups on the aromatic ring, making it a versatile intermediate in organic synthesis and pharmaceutical applications. Its reactive hydroxyl group allows for further functionalization, while the nitro group enhances its utility in electrophilic substitution reactions. The compound exhibits moderate solubility in polar organic solvents, facilitating its use in various chemical processes. Its structural properties make it valuable for the synthesis of dyes, agrochemicals, and specialty chemicals. Proper handling is recommended due to potential sensitivity to light and heat.
4-Hydroxy-3-nitrobenzyl alcohol structure
41833-13-0 structure
Product Name:4-Hydroxy-3-nitrobenzyl alcohol
CAS No:41833-13-0
MF:C7H7NO4
MW:169.134782075882
MDL:MFCD00024249
CID:55485
PubChem ID:142550
Update Time:2025-06-09

4-Hydroxy-3-nitrobenzyl alcohol Chemical and Physical Properties

Names and Identifiers

    • 4-(Hydroxymethyl)-2-nitrophenol
    • 4-Hydroxy-3-nitrobenzyl alcohol
    • 4-Hydroxy-3- Nitrobenzyl Alcohol
    • IMLGJYRKLCMJPI-UHFFFAOYSA-N
    • PubChem22917
    • 3-nitro-4-hydroxybenzyl alcohol
    • Benzenemethanol,4-hydroxy-3-nitro-
    • 4-(Hydroxymethyl)-2-nitrophenol #
    • Benzenemethanol, 4-hydroxy-3-nitro-
    • 5757AB
    • AS05985
    • CM13434
    • VZ29187
    • AK115598
    • ST2405443
    • ST50405826
    • 4-Hydroxy-3-nitrobenzyl alcohol, AldrichCPR
    • SCHEMBL1736272
    • AKOS040763847
    • AKOS007930455
    • CS-W005522
    • AC-22893
    • A23840
    • AMY28200
    • SY001998
    • DTXSID70194642
    • FT-0639740
    • 41833-13-0
    • MFCD00024249
    • DTXCID10117133
    • MDL： MFCD00024249
    • Inchi： 1S/C7H7NO4/c9-4-5-1-2-7(10)6(3-5)8(11)12/h1-3,9-10H,4H2
    • InChI Key： IMLGJYRKLCMJPI-UHFFFAOYSA-N
    • SMILES： OC1C=CC(CO)=CC=1[N+](=O)[O-]

Computed Properties

  • Exact Mass: 169.03800
  • Monoisotopic Mass: 169.038
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 167
  • 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
  • Surface Charge: 0
  • Tautomer Count: 4
  • XLogP3: 1.1
  • Topological Polar Surface Area: 86.3

Experimental Properties

  • Color/Form: Not available
  • Density: 1.4523 (rough estimate)
  • Melting Point: 94-98 °C
  • Boiling Point: 341.3℃ at 760 mmHg
  • Flash Point: 156.6±12.2 °C
  • Refractive Index: 1.5500 (estimate)
  • PSA: 86.28000
  • LogP: 1.31590
  • Solubility: Not available
  • Vapor Pressure: No data available

4-Hydroxy-3-nitrobenzyl alcohol Security Information

4-Hydroxy-3-nitrobenzyl alcohol 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%

4-Hydroxy-3-nitrobenzyl alcohol Pricemore >>

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