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    CAS 26638-66-4

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    CAS 26638-66-4
    Also known as: 26638-66-4, 3,11-dichloro-6-methyl-6,11-dihydrodibenzo[c,f][1,2]thiazepine 5,5-dioxide, 3,11-dichloro-6,11-dihydro-6-methyl-5,5-dioxodibenzo[c,f][1,2]thiazepine, 3,11-dichloro-6-methyl-11h-benzo[c][2,1]benzothiazepine 5,5-dioxide, Dibenzo[c,f][1,2]thiazepine,3,11-dichloro-6,11-dihydro-6-methyl-,5,5-dioxide, Rac 3,11-dichloro-6,11-dihydro-6-methyl-dibenzo[c,f][1,2]thiazepine 5,5-dioxide
    Molecular Formula
    C14H11Cl2NO2S
    Molecular Weight
    328.2  g/mol
    InChI Key
    FHICZIHQHGRZLE-UHFFFAOYSA-N
    1 2D Structure

    CAS 26638-66-4

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    3,11-dichloro-6-methyl-11H-benzo[c][2,1]benzothiazepine 5,5-dioxide
    2.1.2 InChI
    InChI=1S/C14H11Cl2NO2S/c1-17-12-5-3-2-4-10(12)14(16)11-7-6-9(15)8-13(11)20(17,18)19/h2-8,14H,1H3
    2.1.3 InChI Key
    FHICZIHQHGRZLE-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CN1C2=CC=CC=C2C(C3=C(S1(=O)=O)C=C(C=C3)Cl)Cl
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 26638-66-4

    2. 3,11-dichloro-6-methyl-6,11-dihydrodibenzo[c,f][1,2]thiazepine 5,5-dioxide

    3. 3,11-dichloro-6,11-dihydro-6-methyl-5,5-dioxodibenzo[c,f][1,2]thiazepine

    4. 3,11-dichloro-6-methyl-11h-benzo[c][2,1]benzothiazepine 5,5-dioxide

    5. Dibenzo[c,f][1,2]thiazepine,3,11-dichloro-6,11-dihydro-6-methyl-,5,5-dioxide

    6. Rac 3,11-dichloro-6,11-dihydro-6-methyl-dibenzo[c,f][1,2]thiazepine 5,5-dioxide

    7. 3,11-dichloro-6,11-dihydro-6-methyldibenzo(c,f)(1,2)thiazepine 5,5-dioxide

    8. Tianeptine Thiazepinyl Chloride Impurity

    9. Einecs 247-866-8

    10. 3,11-dichloro-6,11-dihydro-6-methyldibenzo[c,f][1,2]thiazepine5,5-dioxide

    11. Schembl6939270

    12. Dtxsid10949471

    13. Bcp30700

    14. Cs-d1747

    15. Ac-323

    16. Mfcd09029354

    17. Akos015889330

    18. As-33020

    19. Am20040056

    20. Ft-0655286

    21. A818541

    22. Q-100335

    23. 3,11-dichloro-6-methyl-6,11-dihydro-5h-5lambda~6~-dibenzo[c,f][1,2]thiazepine-5,5-dione

    24. 3,11-dichloro-6-methyl-6,11-dihydrodibenzo[c,f][1,2]thiazepine 5,5-dioxide, 95%

    25. 3,11-dichloro-6-methyl-6,11-dihydrodibenzo[c,f][1,2]thiazepine5,5-dioxide

    26. 3,11-dichloro-6,11-dihydro-5,5-dioxo-11-hydroxy-6-methyldibenzo[c,f][1,2]thiazepine

    27. 3,11-dichloro-6-methyl-11h-benzo[c][2,1]benzothiazepine 5,5-dioxide;3,11-dichloro-6-methyl-6,11-dihydrodibenzo[c,f][1,2]thiazepine 5,5-dioxide

    2.3 Create Date
    2007-02-08
    3 Chemical and Physical Properties
    Molecular Weight 328.2 g/mol
    Molecular Formula C14H11Cl2NO2S
    XLogP33.4
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count0
    Exact Mass326.9887552 g/mol
    Monoisotopic Mass326.9887552 g/mol
    Topological Polar Surface Area45.8 Ų
    Heavy Atom Count20
    Formal Charge0
    Complexity464
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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      Green Stone Swiss Co ., ltd.is a high-tech enterprise of pharmaceuticals and health ingredients, and provide customized products/OEM/ODM. We signed technical cooperation agreements with 7 Universities of Europe, USA and China, equipped with a set of advanced production and testing equipment to ensure product quality. Our manufactures Factory has first-class production equipment and strict quality management system, which covers an area of 6000 square meters, packing workshop covers 1800 square meters, laboratory covers 260 square meters, building area of 1600 square meters.
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        Green Stone Swiss Co ., ltd.is a high-tech enterprise of pharmaceuticals and health ingredients, and provide customized products/OEM/ODM. We signed technical cooperation agreements with 7 Universities of Europe, USA and China, equipped with a set of advanced production and testing equipment to ensure product quality. Our manufactures Factory has first-class production equipment and strict quality management system, which covers an area of 6000 square meters, packing workshop covers 1800 square meters, laboratory covers 260 square meters, building area of 1600 square meters.
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          Green Stone Swiss Co ., ltd.is a high-tech enterprise of pharmaceuticals and health ingredients, and provide customized products/OEM/ODM. We signed technical cooperation agreements with 7 Universities of Europe, USA and China, equipped with a set of advanced production and testing equipment to ensure product quality. Our manufactures Factory has first-class production equipment and strict quality management system, which covers an area of 6000 square meters, packing workshop covers 1800 square meters, laboratory covers 260 square meters, building area of 1600 square meters.
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              Jinan Chenghui Shuangda Chemical Co., Ltd is subordinate to Chengchuang Pharmaceutical Group, which is fo...
              Jinan Chenghui Shuangda Chemical Co., Ltd is subordinate to Chengchuang Pharmaceutical Group, which is formally established in March, 2002. It is a high-tech enterprise professionally producing pharmaceutical intermediates and fine chemical products inland. The company is located in Chengchuang industrial park, high-tech development district, Ji’nan, the capital city of Shandong Province. It is 1km far from Longitude Ten Road which is the main road of Jinan city, 5km from high way surrounding Ji’nan city and 25km from Yaoqiang airport in Ji’nan. It has superior geographic location and the traffic is very convenient.
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                Jinan Chenghui Shuangda Chemical Co., Ltd is subordinate to Chengchuang Pharmaceutical Group, which is fo...
                Jinan Chenghui Shuangda Chemical Co., Ltd is subordinate to Chengchuang Pharmaceutical Group, which is formally established in March, 2002. It is a high-tech enterprise professionally producing pharmaceutical intermediates and fine chemical products inland. The company is located in Chengchuang industrial park, high-tech development district, Ji’nan, the capital city of Shandong Province. It is 1km far from Longitude Ten Road which is the main road of Jinan city, 5km from high way surrounding Ji’nan city and 25km from Yaoqiang airport in Ji’nan. It has superior geographic location and the traffic is very convenient.
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