Cas no 29669-41-8 (2-Ethoxy-5-nitrobenzonitrile)

2-Ethoxy-5-nitrobenzonitrile structure
2-Ethoxy-5-nitrobenzonitrile structure
Product Name:2-Ethoxy-5-nitrobenzonitrile
CAS No:29669-41-8
MF:C9H8N2O3
MW:192.1714220047
MDL:MFCD02256084
CID:2503230
PubChem ID:16459917
Update Time:2025-04-21

2-Ethoxy-5-nitrobenzonitrile Chemical and Physical Properties

Names and Identifiers

    • 2-Ethoxy-5-nitrobenzonitrile
    • 29669-41-8
    • DB-164319
    • AKOS000304714
    • 2-ethoxy-5-nitro-benzonitrile
    • Benzonitrile, 2-ethoxy-5-nitro-
    • QNHGKWZNRFNTDJ-UHFFFAOYSA-N
    • STK262061
    • MFCD02256084
    • ALBB-005101
    • AKOS015941435
    • DS-3315
    • Y10792
    • MDL: MFCD02256084
    • Inchi: 1S/C9H8N2O3/c1-2-14-9-4-3-8(11(12)13)5-7(9)6-10/h3-5H,2H2,1H3
    • InChI Key: QNHGKWZNRFNTDJ-UHFFFAOYSA-N
    • SMILES: O(CC)C1C=CC(=CC=1C#N)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 192.05349212g/mol
  • Monoisotopic Mass: 192.05349212g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 253
  • 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: 1.8
  • Topological Polar Surface Area: 78.8?2

Experimental Properties

  • Boiling Point: 348°C at 760 mmHg

2-Ethoxy-5-nitrobenzonitrile Security Information

2-Ethoxy-5-nitrobenzonitrile Pricemore >>

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