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    Polpharma is a Polish CDMO of APIs and a significant European API producer, delivering products to companies worldwide.

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    Transo-Pharm GmbH works globally to supply Active Pharmaceutical Ingredients adhering to the highest quality & GMP standards.

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    BUILDING BLOCK

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    Chemistry

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    Also known as: 16292-88-9, Benzenamine, 3-methoxy-4-nitro-, 3-methoxy-4-nitrobenzenamine, Mfcd06661773, Schembl358064, 3-methoxy-4-nitro-phenylamine
    Molecular Formula
    C7H8N2O3
    Molecular Weight
    168.15  g/mol
    InChI Key
    JVUHWSGOORVDML-UHFFFAOYSA-N
    CAS 16292-88-9
    1 2D Structure

    CAS 16292-88-9

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    3-methoxy-4-nitroaniline
    2.1.2 InChI
    InChI=1S/C7H8N2O3/c1-12-7-4-5(8)2-3-6(7)9(10)11/h2-4H,8H2,1H3
    2.1.3 InChI Key
    JVUHWSGOORVDML-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    COC1=C(C=CC(=C1)N)[N+](=O)[O-]
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 16292-88-9

    2. Benzenamine, 3-methoxy-4-nitro-

    3. 3-methoxy-4-nitrobenzenamine

    4. Mfcd06661773

    5. Schembl358064

    6. 3-methoxy-4-nitro-phenylamine

    7. Dtxsid00373125

    8. Amy39256

    9. Cs-m0192

    10. Zb0553

    11. Akos004910300

    12. As-10599

    13. Sy111706

    14. Db-064478

    15. A22610

    16. En300-109120

    17. 3-methoxy-4-nitrobenzenamine;3-methoxy-4-nitroaniline

    2.3 Create Date
    2005-07-19
    3 Chemical and Physical Properties
    Molecular Weight 168.15 g/mol
    Molecular Formula C7H8N2O3
    XLogP31.3
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count1
    Exact Mass g/mol
    Monoisotopic Mass g/mol
    Topological Polar Surface Area81.1
    Heavy Atom Count12
    Formal Charge0
    Complexity169
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1

    BUILDING BLOCK

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