Cas no 42087-82-1 (Methyl 2,6-dinitrobenzoate)

Methyl 2,6-dinitrobenzoate structure
Methyl 2,6-dinitrobenzoate structure
Product Name:Methyl 2,6-dinitrobenzoate
CAS No:42087-82-1
MF:C8H6N2O6
MW:226.143042087555
MDL:MFCD18651712
CID:333102
PubChem ID:333850
Update Time:2025-04-19

Methyl 2,6-dinitrobenzoate Chemical and Physical Properties

Names and Identifiers

    • Methyl 2,6-dinitrobenzoate
    • 2,6-dinitroBenzoic acid methyl ester
    • Benzoic acid,2,6-dinitro-, methyl ester
    • 2,6-Dinitrobenzoesaeuremethylester
    • 2,6-Dinitro-benzoesaeure-methylester
    • 2,6-Di-nitro-benzoesaure-methylester
    • 2,6-dinitro-benzoic acid methyl ester
    • Methyl-2,6-dinitrobenzoat
    • NSC337976
    • MFCD18651712
    • CS-0452339
    • AKOS022183107
    • A913404
    • FT-0751788
    • SY013039
    • 42087-82-1
    • SCHEMBL11398188
    • AC6113
    • AC-23459
    • YZRFTJSIVVNRMI-UHFFFAOYSA-N
    • CS-11268
    • DTXSID70318881
    • NSC-337976
    • DB-070255
    • MDL： MFCD18651712
    • Inchi： 1S/C8H6N2O6/c1-16-8(11)7-5(9(12)13)3-2-4-6(7)10(14)15/h2-4H,1H3
    • InChI Key： YZRFTJSIVVNRMI-UHFFFAOYSA-N
    • SMILES： O(C)C(C1C(=CC=CC=1[N+](=O)[O-])[N+](=O)[O-])=O

Computed Properties

  • Exact Mass: 226.02258
  • Monoisotopic Mass: 226.022586
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 4
  • Complexity: 285
  • 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: 118

Experimental Properties

  • Density: 1.497
  • Boiling Point: 323°C at 760 mmHg
  • Flash Point: 151.5°C
  • Refractive Index: 1.592
  • PSA: 112.58

Methyl 2,6-dinitrobenzoate Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd.
Y00895-250mg
Methyl 2,6-dinitrobenzoate
 42087-82-1 97%
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SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd.
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Chemenu
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Chemenu
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Apollo Scientific
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 42087-82-1
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 ￡210.00 2023-08-31
Apollo Scientific
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eNovation Chemicals LLC
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eNovation Chemicals LLC
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 42087-82-1 97%
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eNovation Chemicals LLC
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SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
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