Cas no 142596-50-7 (3-Methoxy-2-nitrobenzonitrile)

3-Methoxy-2-nitrobenzonitrile structure
3-Methoxy-2-nitrobenzonitrile structure
Product Name:3-Methoxy-2-nitrobenzonitrile
CAS No:142596-50-7
MF:C8H6N2O3
MW:178.14484167099
MDL:MFCD18382535
CID:135653
PubChem ID:10374991
Update Time:2025-04-19

3-Methoxy-2-nitrobenzonitrile Chemical and Physical Properties

Names and Identifiers

    • 3-Methoxy-2-nitrobenzonitrile
    • 3-METHOXY-2-NITRO-BENZONITRILE
    • Benzonitrile,3-methoxy-2-nitro-
    • 3-Methoxy-2-nitro-benzonitril
    • BEN163
    • Benzonitrile,3-methoxy-2-nitro
    • DTXSID10438855
    • 142596-50-7
    • Benzonitrile, 3-methoxy-2-nitro-
    • SY250040
    • FT-0765084
    • MFCD18382535
    • CS-0084921
    • AC-24342
    • 3-METHOXY-2-NITRO BENZONITRILE
    • AS-33160
    • SCHEMBL2258495
    • AKOS015911987
    • OXWWZQUPPXKYQB-UHFFFAOYSA-N
    • J-512753
    • C8H6N2O3
    • A856837
    • DB-049968
    • MDL: MFCD18382535
    • Inchi: 1S/C8H6N2O3/c1-13-7-4-2-3-6(5-9)8(7)10(11)12/h2-4H,1H3
    • InChI Key: OXWWZQUPPXKYQB-UHFFFAOYSA-N
    • SMILES: O(C)C1C=CC=C(C#N)C=1[N+](=O)[O-]

Computed Properties

  • Exact Mass: 178.03800
  • Monoisotopic Mass: 178.03784206g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • 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
  • XLogP3: 1.4
  • Topological Polar Surface Area: 78.8?2

Experimental Properties

  • Density: 1.32±0.1 g/cm3 (20 oC 760 Torr),
  • Melting Point: 122 oC (benzene ligroine )
  • Solubility: Very slightly soluble (0.59 g/l) (25 o C),
  • PSA: 78.84000
  • LogP: 1.99828

3-Methoxy-2-nitrobenzonitrile Customs Data

  • HS CODE:2926909090
  • Customs Data:

    China Customs Code:

    2926909090

    Overview:

    2926909090 Other nitrile based compounds. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

3-Methoxy-2-nitrobenzonitrile Pricemore >>

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3-Methoxy-2-nitrobenzonitrile Production Method

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