Cas no 88312-64-5 (Methyl 2-amino-5-nitronicotinate)

Methyl 2-amino-5-nitronicotinate structure
88312-64-5 structure
Product Name:Methyl 2-amino-5-nitronicotinate
CAS No:88312-64-5
MF:C7H7N3O4
MW:197.148181200027
MDL:MFCD19441225
CID:637716
PubChem ID:13063488
Update Time:2025-08-04

Methyl 2-amino-5-nitronicotinate Chemical and Physical Properties

Names and Identifiers

    • Methyl 2-amino-5-nitronicotinate
    • 3-Pyridinecarboxylic acid, 2-amino-5-nitro-, methyl ester
    • methyl 2-amino-5-nitropyridine-3-carboxylate
    • 2-Amino-5-nitro-nicotinic acid methyl ester
    • 2-amino-3-(methoxycarbonyl)-5-nitropyridine
    • 2-amino-5-nitronicotinic acid methyl ester
    • OUMPFIBIUJBCAH-UHFFFAOYSA-N
    • BCP23417
    • CM0102
    • ST24025215
    • W9053
    • 2-Amino-5-nitropyridine-3-carboxylic acid methyl ester
    • 3-Pyridinecarboxylic acid, 2-a
    • Methyl 2-amino-5-nitro-3-pyridinecarboxylate (ACI)
    • DS-14607
    • SCHEMBL1680354
    • 88312-64-5
    • DTXSID30516907
    • MFCD19441225
    • SY271843
    • Methyl2-amino-5-nitronicotinate
    • SB52648
    • AKOS015995172
    • s11687
    • EN300-2008315
    • CS-0042659
    • MDL: MFCD19441225
    • Inchi: 1S/C7H7N3O4/c1-14-7(11)5-2-4(10(12)13)3-9-6(5)8/h2-3H,1H3,(H2,8,9)
    • InChI Key: OUMPFIBIUJBCAH-UHFFFAOYSA-N
    • SMILES: O=C(C1C(N)=NC=C([N+](=O)[O-])C=1)OC

Computed Properties

  • Exact Mass: 197.04400
  • Monoisotopic Mass: 197.04365571g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 240
  • 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: 111
  • XLogP3: 0.7

Experimental Properties

  • PSA: 111.03000
  • LogP: 1.46300

Methyl 2-amino-5-nitronicotinate Customs Data

  • HS CODE:2933399090
  • Customs Data:

    China Customs Code:

    2933399090

    Overview:

    2933399090. Other compounds with non fused pyridine rings in structure. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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Methyl 2-amino-5-nitronicotinate Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Sulfuric acid ,  Nitric acid ;  0 °C; 0 °C → rt; 2 h, rt
1.2 Reagents: Sodium carbonate Solvents: Water ;  pH 8, 0 °C
Reference
Rational multistep synthesis of a novel polyfunctionalized benzo[d]thiazole and its thiazolo[5,4-b]pyridine analogue
Hedou, Damien; et al, Tetrahedron, 2014, 70(35), 5541-5549

Production Method 2

Reaction Conditions
1.1 Reagents: Sulfuric acid ,  Nitric acid Solvents: Water ;  45 min, 0 °C; 19 h, rt; 4 h, 70 °C; 70 °C → 0 °C
1.2 Reagents: Sodium bicarbonate Solvents: Water ;  pH 8
Reference
Discovery and Optimization of a Compound Series Active against Trypanosoma cruzi, the Causative Agent of Chagas Disease
Harrison, Justin R.; et al, Journal of Medicinal Chemistry, 2020, 63(6), 3066-3089

Production Method 3

Reaction Conditions
1.1 Reagents: Sulfuric acid ;  0 °C; 1.5 h, 60 °C
1.2 Reagents: Sodium carbonate Solvents: Water ;  pH 8, 0 °C
2.1 Reagents: Sulfuric acid ,  Nitric acid ;  0 °C; 0 °C → rt; 2 h, rt
2.2 Reagents: Sodium carbonate Solvents: Water ;  pH 8, 0 °C
Reference
Rational multistep synthesis of a novel polyfunctionalized benzo[d]thiazole and its thiazolo[5,4-b]pyridine analogue
Hedou, Damien; et al, Tetrahedron, 2014, 70(35), 5541-5549

Methyl 2-amino-5-nitronicotinate Raw materials

Methyl 2-amino-5-nitronicotinate Preparation Products

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