Cas no 84228-45-5 (Methyl 4-amino-2-nitrobenzoate)

Methyl 4-amino-2-nitrobenzoate structure
84228-45-5 structure
Product Name:Methyl 4-amino-2-nitrobenzoate
CAS No:84228-45-5
MF:C8H8N2O4
MW:196.160121917725
MDL:MFCD00228651
CID:707141
PubChem ID:14730691
Update Time:2024-10-26

Methyl 4-amino-2-nitrobenzoate Chemical and Physical Properties

Names and Identifiers

    • Methyl 4-amino-2-nitrobenzoate
    • Benzoic acid,4-amino-2-nitro-, methyl ester
    • 4-Amino-2-nitrobenzoic acid methyl ester
    • DTXSID60563404
    • STK664055
    • Benzoic acid, 4-amino-2-nitro-, methyl ester
    • CWNMNVHDDCDSPU-UHFFFAOYSA-N
    • SCHEMBL616603
    • SY244023
    • CS-0128687
    • CL9027
    • SB73980
    • AKOS003237962
    • methyl4-amino-2-nitrobenzoate
    • Methyl 2-Nitro-4-aminobenzoate
    • ALBB-024857
    • AS-46177
    • Benzoic acid, 4-amino-2-nitro-, methyl ester (9CI)
    • 84228-45-5
    • MFCD00228651
    • EN300-6747099
    • MDL: MFCD00228651
    • Inchi: 1S/C8H8N2O4/c1-14-8(11)6-3-2-5(9)4-7(6)10(12)13/h2-4H,9H2,1H3
    • InChI Key: CWNMNVHDDCDSPU-UHFFFAOYSA-N
    • SMILES: O=C(C1C([N+](=O)[O-])=CC(N)=CC=1)OC

Computed Properties

  • Exact Mass: 196.04840674g/mol
  • Monoisotopic Mass: 196.04840674g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 238
  • 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
  • Topological Polar Surface Area: 98.1?2

Experimental Properties

  • Density: 1.386±0.06 g/cm3(Predicted)
  • Boiling Point: 391.8±22.0 °C(Predicted)

Methyl 4-amino-2-nitrobenzoate Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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abcr
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