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    CAS 15861-24-2
    Also known as: 15861-24-2, 1h-indole-5-carbonitrile, Indole-5-carbonitrile, 5-cyano-1h-indole, 5-cyano indole, Mfcd00005669
    Molecular Formula
    C9H6N2
    Molecular Weight
    142.16  g/mol
    InChI Key
    YHYLDEVWYOFIJK-UHFFFAOYSA-N
    1 2D Structure

    CAS 15861-24-2

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1H-indole-5-carbonitrile
    2.1.2 InChI
    InChI=1S/C9H6N2/c10-6-7-1-2-9-8(5-7)3-4-11-9/h1-5,11H
    2.1.3 InChI Key
    YHYLDEVWYOFIJK-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=CC2=C(C=CN2)C=C1C#N
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 15861-24-2

    2. 1h-indole-5-carbonitrile

    3. Indole-5-carbonitrile

    4. 5-cyano-1h-indole

    5. 5-cyano Indole

    6. Mfcd00005669

    7. Chembl294926

    8. 1h-indole-5-carbonitrile, Homopolymer

    9. 91201-84-2

    10. Einecs 239-986-4

    11. 5-cyano-indole

    12. 5-indolecarbonitrile

    13. Indol-5-carbonitrile

    14. Indole, 5-cyano-

    15. Schembl91366

    16. Indole-5-carbonitrile, 99%

    17. Dtxsid40166477

    18. Zinc157017

    19. Act03557

    20. Albb-022905

    21. Bcp26499

    22. Cs-m1444

    23. Str04400

    24. Bdbm50220678

    25. Stk802138

    26. Akos005206715

    27. Ac-7424

    28. Cg-0514

    29. Pb25883

    30. Sb20070

    31. Ncgc00340972-01

    32. 240812-99-1

    33. Bp-10151

    34. Sy006206

    35. Db-014571

    36. Am20060210

    37. Ft-0627223

    38. Ft-0627224

    39. 61c242

    40. C-8840

    41. Ab01331743-02

    42. F2158-0363

    43. Z1741968206

    44. A3327a31-2a0c-4860-8157-f2773de25b9e

    2.3 Create Date
    2005-03-27
    3 Chemical and Physical Properties
    Molecular Weight 142.16 g/mol
    Molecular Formula C9H6N2
    XLogP32.4
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count1
    Rotatable Bond Count0
    Exact Mass142.053098200 g/mol
    Monoisotopic Mass142.053098200 g/mol
    Topological Polar Surface Area39.6 Ų
    Heavy Atom Count11
    Formal Charge0
    Complexity191
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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        Founded in 2003, Senary Chem is one of the Key High-Tech Enterprises of National Torch Plan. Senary located in National Cangzhou Lingang Economic and Technological Development Zone,Cangzhou City,Hebei Province. Senary cover an area of 67,000 square meters, and 300 professionals work there. Senary R&D organization recognized as the Hebei Provincial Engineering Technology Center is comprised of two R & D centers in Tianjin and Cangzhou, and it employs 80 experienced scientists in total. Senary focus on the development, production and sales of advanced pharmaceutical intermediates. Especially, Senary has leading technology and manufacturing capacity for diabetes drug intermediates. All intermediates of DPP4 and SGLT2 class drugs on market have been commercialized production. Senary has 150 sets of 50 ~ 8000L reactor with annual production capacity of 1,000 tons, which can handle both low and high temperature reactions within -100 ~ 240 ℃ range, all kinds of catalytic reactions within 0 ~ 5MPa pressure, and moisture and/or oxygen sensitive reactions. Senary also has expertise in chiral synthesis with leading technologies. The advanced sewage treatment system at Senery has processing capacity of 600 tons daily. Senary has an excellent team that has rich quality management experience.We have established a set of normative and perfect quality managment system,monitoring the whole process of risk assessment,R&D,transfer from pilot scale to commercial production,manufacturing,analysis and sales service. Senary will continue to dedicate on the field of pharmaceutical intermediates to provide the best service for domestic and foreign API pharmaceutical companies with high quality and timely supply of products.
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          Founded in 2003, Senary Chem is one of the Key High-Tech Enterprises of National Torch Plan. Senary located in National Cangzhou Lingang Economic and Technological Development Zone,Cangzhou City,Hebei Province. Senary cover an area of 67,000 square meters, and 300 professionals work there. Senary R&D organization recognized as the Hebei Provincial Engineering Technology Center is comprised of two R & D centers in Tianjin and Cangzhou, and it employs 80 experienced scientists in total. Senary focus on the development, production and sales of advanced pharmaceutical intermediates. Especially, Senary has leading technology and manufacturing capacity for diabetes drug intermediates. All intermediates of DPP4 and SGLT2 class drugs on market have been commercialized production. Senary has 150 sets of 50 ~ 8000L reactor with annual production capacity of 1,000 tons, which can handle both low and high temperature reactions within -100 ~ 240 ℃ range, all kinds of catalytic reactions within 0 ~ 5MPa pressure, and moisture and/or oxygen sensitive reactions. Senary also has expertise in chiral synthesis with leading technologies. The advanced sewage treatment system at Senery has processing capacity of 600 tons daily. Senary has an excellent team that has rich quality management experience.We have established a set of normative and perfect quality managment system,monitoring the whole process of risk assessment,R&D,transfer from pilot scale to commercial production,manufacturing,analysis and sales service. Senary will continue to dedicate on the field of pharmaceutical intermediates to provide the best service for domestic and foreign API pharmaceutical companies with high quality and timely supply of products.
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