menu
    • menu

    138229-59-1 manufacturers and suppliers on PharmaCompass

    Seqens is an integrated global leader in pharmaceutical solutions & specialty ingredients & provides custom-made solutions.

    Virtual Booth

    Contact Supplier

    AbbVie CDMO has been working with global companies to develop, manufacture & scale biopharmaceutical products.

    Virtual Booth

    Contact Supplier

    xyz-pharma-m-2024-10-07

    Virtual Booth

    Contact Supplier

    EUROAPI, the leading small molecules API player, provides both API sales & CDMO services.

    Virtual Booth

    Contact Supplier

    ChemWerth works in generic API development & supply, non-infringement patent strategy development and regulatory support.

    Virtual Booth

    Contact Supplier

    xyz-pharma-m-2024-10-07

    Virtual Booth

    Contact Supplier

    BUILDING BLOCK

    PharmaCompass

    Chemistry

    Click the arrow to open the dropdown
    read-moreClick the button for full data set
    read-moreClick the button for full data set
    Also known as: 138229-59-1, 3-formyl-2-nitrobenzoic acid methyl ester, Benzoic acid, 3-formyl-2-nitro-, methyl ester, Methyl3-formyl-2-nitrobenzoate, Ak-59657, Schembl358711
    Molecular Formula
    C9H7NO5
    Molecular Weight
    209.16  g/mol
    InChI Key
    NSLOBVGASZUPDO-UHFFFAOYSA-N
    138229-59-1
    1 2D Structure

    138229-59-1

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    methyl 3-formyl-2-nitrobenzoate
    2.1.2 InChI
    InChI=1S/C9H7NO5/c1-15-9(12)7-4-2-3-6(5-11)8(7)10(13)14/h2-5H,1H3
    2.1.3 InChI Key
    NSLOBVGASZUPDO-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    COC(=O)C1=CC=CC(=C1[N+](=O)[O-])C=O
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 138229-59-1

    2. 3-formyl-2-nitrobenzoic Acid Methyl Ester

    3. Benzoic Acid, 3-formyl-2-nitro-, Methyl Ester

    4. Methyl3-formyl-2-nitrobenzoate

    5. Ak-59657

    6. Schembl358711

    7. Dtxsid10659301

    8. Methyl 2-nitro-3-aldehydebenzoate

    9. Amy12262

    10. Bcp20550

    11. Mfcd14706049

    12. Zinc72233115

    13. Akos015969533

    14. Sb40715

    15. Methyl 3-formyl-2-nitrobenzoate, 95%

    16. Ac-30679

    17. Ds-16334

    18. Cs-0022127

    19. A886268

    2.3 Create Date
    2010-01-19
    3 Chemical and Physical Properties
    Molecular Weight 209.16 g/mol
    Molecular Formula C9H7NO5
    XLogP31.1
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count5
    Rotatable Bond Count3
    Exact Mass209.03242232 g/mol
    Monoisotopic Mass209.03242232 g/mol
    Topological Polar Surface Area89.2 Ų
    Heavy Atom Count15
    Formal Charge0
    Complexity272
    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

    Upload your portfolio for free, ask us

    END USE APIs

    read-more
    read-more
    Ask Us for Pharmaceutical Supplier and Partner
    Ask Us, Find A Supplier / Partner
    No Commissions, No Strings Attached, Get Connected for FREE

    What are you looking for?

    How can we help you?

    The request can't be empty

    Please read our Privacy Policy carefully

    You must agree to the privacy policy

    The name can't be empty
    The company can't be empty.
    The email can't be empty Please enter a valid email.
    The mobile can't be empty

    Market Place

    Market Place

    PharmaCompass

    Home

    Market Place

    Menu

    Post Enquiry

    Post Enquiry

    Market Place

    Market Place

    Search