Cas no 10230-68-9 (1-nitropropan-2-one)

1-nitropropan-2-one structure
1-nitropropan-2-one structure
Product Name:1-nitropropan-2-one
CAS No:10230-68-9
MF:C3H5NO3
MW:103.076700925827
MDL:MFCD07438003
CID:222272
PubChem ID:66296
Update Time:2025-04-19

1-nitropropan-2-one Chemical and Physical Properties

Names and Identifiers

    • 2-Propanone, 1-nitro-
    • 1-NITROACETONE
    • 1-nitropropan-2-one
    • NITROACETONE
    • 1-Nitro-2-propanone
    • 2-Propanone,1-nitro
    • nitro-2-propanone
    • nitro-acetone
    • nitropropanone
    • AKOS006239749
    • AM86220
    • DTXSID90144886
    • 10230-68-9
    • CS-0440099
    • SCHEMBL2441916
    • MFCD07438003
    • EN300-234114
    • SY285532
    • A18025
    • 1-Nitroacetone #
    • propanone, 1-nitro-
    • MDL: MFCD07438003
    • Inchi: 1S/C3H5NO3/c1-3(5)2-4(6)7/h2H2,1H3
    • InChI Key: QCDJOJKIHZQJGX-UHFFFAOYSA-N
    • SMILES: O=C(C)C[N+](=O)[O-]

Computed Properties

  • Exact Mass: 103.02700
  • Monoisotopic Mass: 103.026943022g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 7
  • Rotatable Bond Count: 2
  • Complexity: 92.8
  • 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: -0.1
  • Topological Polar Surface Area: 62.9?2

Experimental Properties

  • Density: 1.4873 (rough estimate)
  • Melting Point: 50.3°C
  • Boiling Point: 193.26°C (rough estimate)
  • Refractive Index: 1.4940 (estimate)
  • PSA: 62.89000
  • LogP: 0.37530

1-nitropropan-2-one Pricemore >>

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1-nitropropan-2-one Production Method

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