Cas no 63989-82-2 (3,5-Dinitro-p-cresol)

3,5-Dinitro-p-cresol (DNPC) is a nitrated phenolic compound with the molecular formula C?H?N?O?. It is primarily recognized for its role as a herbicide and insecticide, exhibiting selective phytotoxicity and effectiveness against broadleaf weeds and certain pests. The compound's nitro groups enhance its reactivity, making it useful in chemical synthesis and industrial applications. DNPC is also employed as a biochemical inhibitor, particularly in studies targeting oxidative phosphorylation. Its crystalline form ensures stability and ease of handling in laboratory settings. Due to its potent biological activity, proper safety measures, including personal protective equipment, are essential when handling this compound. DNPC is valued for its specificity and efficacy in agricultural and research applications.
3,5-Dinitro-p-cresol structure
3,5-Dinitro-p-cresol structure
Product Name:3,5-Dinitro-p-cresol
CAS No:63989-82-2
MF:C7H6N2O5
MW:198.13294172287
CID:503592
PubChem ID:46156
Update Time:2025-05-28

3,5-Dinitro-p-cresol Chemical and Physical Properties

Names and Identifiers

    • Phenol,4-methyl-3,5-dinitro-
    • 3,5-dinitro-p-cresol
    • 4-methyl-3,5-dinitrophenol
    • 264-594-5
    • p-CRESOL, 3,5-DINITRO-
    • 3,5-Dinitro-p-kresol
    • SCHEMBL11273954
    • 63989-82-2
    • AKOS004121770
    • NS00035613
    • DTXSID10213922
    • EINECS 264-594-5
    • 3,5-Dinitro-p-cresol
    • Inchi： 1S/C7H6N2O5/c1-4-6(8(11)12)2-5(10)3-7(4)9(13)14/h2-3,10H,1H3
    • InChI Key： HTAMNOAYOHLVPQ-UHFFFAOYSA-N
    • SMILES： OC1C=C(C(C)=C(C=1)[N+](=O)[O-])[N+](=O)[O-]

Computed Properties

  • Exact Mass: 198.02768
  • Monoisotopic Mass: 198.027671
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 0
  • Complexity: 221
  • 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: 1.4
  • Topological Polar Surface Area: 112

Experimental Properties

  • Density: 1.5928 (rough estimate)
  • Melting Point: 154.5°C
  • Boiling Point: 335.43°C (rough estimate)
  • Flash Point: 150.1°C
  • Refractive Index: 1.5460 (estimate)
  • PSA: 106.51

3,5-Dinitro-p-cresol Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
1661350-5g
4-Methyl-3,5-dinitrophenol
 63989-82-2 98%
5g
 ￥11499.00 2024-05-05
SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
1661350-10g
4-Methyl-3,5-dinitrophenol
 63989-82-2 98%
10g
 ￥16215.00 2024-05-05
SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
1661350-25g
4-Methyl-3,5-dinitrophenol
 63989-82-2 98%
25g
 ￥29238.00 2024-05-05

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