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    CAS 915095-84-0

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    CAS 915095-84-0
    Also known as: 915095-84-0, U6vk5xr83j, (s)-(5-bromo-2-chlorophenyl)(4-(tetrahydrofuran-3-yloxy)phenyl)methanone, Schembl2864061, (5-bromo-2-chlorophenyl)-(4-((3s)-oxolan-3-yl)oxyphenyl)methanone, Methanone, (5-bromo-2-chlorophenyl)(4-(((3s)-tetrahydro-3-furanyl)oxy)phenyl)-
    Molecular Formula
    C17H14BrClO3
    Molecular Weight
    381.6  g/mol
    InChI Key
    DGMVPGOZCCHBQI-AWEZNQCLSA-N
    FDA UNII
    U6VK5XR83J
    1 2D Structure

    CAS 915095-84-0

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (5-bromo-2-chlorophenyl)-[4-[(3S)-oxolan-3-yl]oxyphenyl]methanone
    2.1.2 InChI
    InChI=1S/C17H14BrClO3/c18-12-3-6-16(19)15(9-12)17(20)11-1-4-13(5-2-11)22-14-7-8-21-10-14/h1-6,9,14H,7-8,10H2/t14-/m0/s1
    2.1.3 InChI Key
    DGMVPGOZCCHBQI-AWEZNQCLSA-N
    2.1.4 Canonical SMILES
    C1COCC1OC2=CC=C(C=C2)C(=O)C3=C(C=CC(=C3)Br)Cl
    2.1.5 Isomeric SMILES
    C1COC[C@H]1OC2=CC=C(C=C2)C(=O)C3=C(C=CC(=C3)Br)Cl
    2.2 Other Identifiers
    2.2.1 UNII
    U6VK5XR83J
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 915095-84-0

    2. U6vk5xr83j

    3. (s)-(5-bromo-2-chlorophenyl)(4-(tetrahydrofuran-3-yloxy)phenyl)methanone

    4. Schembl2864061

    5. (5-bromo-2-chlorophenyl)-(4-((3s)-oxolan-3-yl)oxyphenyl)methanone

    6. Methanone, (5-bromo-2-chlorophenyl)(4-(((3s)-tetrahydro-3-furanyl)oxy)phenyl)-

    7. Unii-u6vk5xr83j

    8. Empagliflozin 5-bromo Keto Analog

    9. Ac-29162

    10. Ak144267

    11. Db-092433

    12. Cs-0166100

    13. F75628

    14. (5-bromo-2-chlorophenyl)(4-(((3s)-tetrahydro-3-furanyl)oxy)phenyl)methanone

    15. (s)-(5-bromo-2-chlorophenyl)(4-((tetrahydrofuran-3-yl)oxy)phenyl)methanone? (empagliflozin Impurity

    2.4 Create Date
    2012-08-20
    3 Chemical and Physical Properties
    Molecular Weight 381.6 g/mol
    Molecular Formula C17H14BrClO3
    XLogP34.6
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count4
    Exact Mass379.98148 g/mol
    Monoisotopic Mass379.98148 g/mol
    Topological Polar Surface Area35.5 Ų
    Heavy Atom Count22
    Formal Charge0
    Complexity384
    Isotope Atom Count0
    Defined Atom Stereocenter Count1
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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      (5-Bromo-2-Chlorophenyl)[4-[[(3S)-T...
      SS Pharmaceutical develops and manufactures active pharmaceutical ingredients (APIs), registered pharma i...
      SS Pharmaceutical develops and manufactures active pharmaceutical ingredients (APIs), registered pharma intermediates, fine chemicals and pyridine derivatives for the domestic as well as international market. SS Pharma’s research activities extend from the development of active pharmaceuticals to fixed dose formulations for regulated markets. Its manufacturing facilities are state-of-the-art, multipurpose sites that comply with cGMP standards and meet the requirements of the US and EU drug regulatory authorities. SS Pharma is a CGMP, ISO 9001-2008 and ISO 14000:2004 certified company.
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      We are one of the well-known manufacturers of key APIs & intermediates in China, with 20 years of experie...
      We are one of the well-known manufacturers of key APIs & intermediates in China, with 20 years of experience & presence in 20+ countries. At Boyuan, we are committed to providing high-quality products & services. Formerly known as “Jinan Boyuan Chemical Co., Ltd” & “Shandong Boyuan Chemical Co., Ltd.” Boyuan was founded in June 2001. We have 2 manufacturing plants in the cities of Jiyang & Yucheng in Shandong Province, China & both are in line with the GMP standard, following a strict quality system & conforming with international standards. Boyuan is dedicated to anti-cancer, anti-fungal & other APIs & intermediates associated.
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        The Bakul Group of companies headquartered in Mumbai, India are engaged in the development and manufactur...
        The Bakul Group of companies headquartered in Mumbai, India are engaged in the development and manufacture of high-quality Active Pharmaceutical Ingredients (APIs), Intermediates, and Speciality Chemicals. Since our inception in 1975, we have grown to become world leaders in the area of xanthine chemistry. They specialize in manufacturing APIs such as Linagliptin, Pentoxifylline, Theobromine, Doxofylline, Caffeine, Pamabrom, and others.
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        ZCL Chemicals Ltd is an 100% Export Oriented Unit (EOU) that combines the power of science & technology. ...
        ZCL Chemicals Ltd is an 100% Export Oriented Unit (EOU) that combines the power of science & technology. Established in 1991, the company head quarter is in Mumbai .The R&D Center and cGMP-manufacturing facility is in the Industrial heart of Ankleshwar city in Gujarat, 300 k.m. North of Mumbai, well connected by Road, Rail and Air enabling swift cargo movement to the nearest major sea/airport being Mumbai. The Company delivers a broad range of advance fine chemical intermediates and active.
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