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    CAS 1006376-62-0

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    CAS 1006376-62-0
    Also known as: 1006376-62-0, (1r,2r)-2-(3,4-difluorophenyl)cyclopropane-1-carboxamide, (1r,2r)-2-(3,4-difluorophenyl)cyclopropane carboxamide, 1006614-51-2, Rel-(1r,2r)-2-(3,4-difluorophenyl)cyclopropane-1-carboxamide, Schembl2397845
    Molecular Formula
    C10H9F2NO
    Molecular Weight
    197.18  g/mol
    InChI Key
    PYEJQVYISBUGDU-NKWVEPMBSA-N
    1 2D Structure

    CAS 1006376-62-0

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (1R,2R)-2-(3,4-difluorophenyl)cyclopropane-1-carboxamide
    2.1.2 InChI
    InChI=1S/C10H9F2NO/c11-8-2-1-5(3-9(8)12)6-4-7(6)10(13)14/h1-3,6-7H,4H2,(H2,13,14)/t6-,7+/m0/s1
    2.1.3 InChI Key
    PYEJQVYISBUGDU-NKWVEPMBSA-N
    2.1.4 Canonical SMILES
    C1C(C1C(=O)N)C2=CC(=C(C=C2)F)F
    2.1.5 Isomeric SMILES
    C1[C@H]([C@@H]1C(=O)N)C2=CC(=C(C=C2)F)F
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 1006376-62-0

    2. (1r,2r)-2-(3,4-difluorophenyl)cyclopropane-1-carboxamide

    3. (1r,2r)-2-(3,4-difluorophenyl)cyclopropane Carboxamide

    4. 1006614-51-2

    5. Rel-(1r,2r)-2-(3,4-difluorophenyl)cyclopropane-1-carboxamide

    6. Schembl2397845

    7. Amy3282

    8. Dtxsid30657804

    9. Mfcd22380631

    10. Ac-32549

    11. Cs-15280

    12. Cs-0009935

    13. I11942

    2.3 Create Date
    2009-09-08
    3 Chemical and Physical Properties
    Molecular Weight 197.18 g/mol
    Molecular Formula C10H9F2NO
    XLogP31.2
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count2
    Exact Mass g/mol
    Monoisotopic Mass g/mol
    Topological Polar Surface Area43.1
    Heavy Atom Count14
    Formal Charge0
    Complexity246
    Isotope Atom Count0
    Defined Atom Stereocenter Count2
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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      VIDGAS aims to provide our pharmaceutical, Bio pharma, Agrochemical, Food and Fine chemical customers wit...
      VIDGAS aims to provide our pharmaceutical, Bio pharma, Agrochemical, Food and Fine chemical customers with the highest quality SFC and HPLC purification and isolation solutions that market has to offer. With our 25 years of HPLC experience, we are able to provide variety of products with custom tailored answers for even most difficult separations. Our team of professional Chromatographers is available to assist in HPLC and SFC methods development solutions. Here at VIDGAS we are constantly innovating and pursuing the limits of HPLC and SFC.
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