Cas no 55737-66-1 (4-(Methoxycarbonyl)-2-nitrobenzoic acid)

4-(Methoxycarbonyl)-2-nitrobenzoic acid structure
55737-66-1 structure
Product Name:4-(Methoxycarbonyl)-2-nitrobenzoic acid
CAS No:55737-66-1
MF:C9H7NO6
MW:225.154982805252
MDL:MFCD06203344
CID:89867
PubChem ID:21906474
Update Time:2025-04-18

4-(Methoxycarbonyl)-2-nitrobenzoic acid Chemical and Physical Properties

Names and Identifiers

    • 4-(Methoxycarbonyl)-2-nitrobenzoic acid
    • 2-Nitroterephthalic acid 4-methyl ester
    • 4-methoxycarbonyl-2-nitrobenzoic acid
    • 2-Nitro-4-methoxycarbonyl benzoic acid
    • Methyl 3-nitro-4-carboxybenzoate
    • methyl 4-carboxy-3-nitrobenzoate
    • nitro-terephthalic acid-4-methyl ester
    • Nitro-terephthalsaeure-4-methylester
    • DTXSID00619858
    • FT-0701453
    • A870110
    • PB43050
    • CS-0046813
    • VULISSQANNKDCH-UHFFFAOYSA-N
    • W15619
    • EN300-22692
    • 4-(Methoxycarbonyl)-2-nitrobenzoicacid
    • AKOS016009853
    • AS-64141
    • 2-Nitro-4-methoxycarbonyl benzoic acid
    • 2-nitro-terephthalic acid 4-methyl ester
    • SCHEMBL2116235
    • 4-carbomethoxy-2-nitrobenzoic acid
    • 55737-66-1
    • MFCD06203344
    • SY103806
    • DA-04898
    • MDL: MFCD06203344
    • Inchi: 1S/C9H7NO6/c1-16-9(13)5-2-3-6(8(11)12)7(4-5)10(14)15/h2-4H,1H3,(H,11,12)
    • InChI Key: VULISSQANNKDCH-UHFFFAOYSA-N
    • SMILES: O(C)C(C1C=CC(C(=O)O)=C(C=1)[N+](=O)[O-])=O

Computed Properties

  • Exact Mass: 225.02700
  • Monoisotopic Mass: 225.02733694g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 4
  • Complexity: 310
  • 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: 1.3
  • Topological Polar Surface Area: 109?2

Experimental Properties

  • Density: 1.486
  • Melting Point: 133-135°C
  • Boiling Point: 393.5°C at 760 mmHg
  • Flash Point: 191.8°C
  • Refractive Index: 1.589
  • Water Partition Coefficient: Insoluble in water.
  • PSA: 109.42000
  • LogP: 1.60280

4-(Methoxycarbonyl)-2-nitrobenzoic acid Customs Data

  • HS CODE:2918990090
  • Customs Data:

    China Customs Code:

    2918990090

    Overview:

    2918990090. Other additional oxy carboxylic acids(Including anhydrides\Acyl halide\Peroxides, peroxyacids and derivatives of this tax number). VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2918990090. other carboxylic acids with additional oxygen function and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

4-(Methoxycarbonyl)-2-nitrobenzoic acid Pricemore >>

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