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    CAS 100-59-4

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    CAS 100-59-4
    Also known as: 100-59-4, Magnesium, chlorophenyl-, Chlorophenylmagnesium, Mfcd00000464, Phenyl magnesium chloride, Phenylmagnesium chloride, 1.0 m in 2-methf
    Molecular Formula
    C6H5ClMg
    Molecular Weight
    136.86  g/mol
    InChI Key
    IWCVDCOJSPWGRW-UHFFFAOYSA-M
    1 2D Structure

    CAS 100-59-4

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    magnesium;benzene;chloride
    2.1.2 InChI
    InChI=1S/C6H5.ClH.Mg/c1-2-4-6-5-3-1;;/h1-5H;1H;/q-1;;+2/p-1
    2.1.3 InChI Key
    IWCVDCOJSPWGRW-UHFFFAOYSA-M
    2.1.4 Canonical SMILES
    C1=CC=[C-]C=C1.[Mg+2].[Cl-]
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 100-59-4

    2. Magnesium, Chlorophenyl-

    3. Chlorophenylmagnesium

    4. Mfcd00000464

    5. Phenyl Magnesium Chloride

    6. Phenylmagnesium Chloride, 1.0 M In 2-methf

    7. Phenylmagnesiumchloride

    8. Phenyl-magnesium Chloride

    9. Phmgcl

    10. Unii-739y484f5h

    11. Hsdb 5336

    12. Einecs 202-868-8

    13. Phenylmagnesiu

    14. Chloro(phenyl)magnesium

    15. Ec 202-868-8

    16. Schembl1486

    17. Dtxsid8059215

    18. Chebi:51490

    19. Gqonlaszrvfghi-uhfffaoysa-m

    20. Akos009159060

    21. 739y484f5h

    22. Phenylmagnesium Chloride, 2-3m In Thf

    23. Phenylmagnesium Chloride, 1.0 M In Thf

    24. F20531

    25. J-802275

    2.3 Create Date
    2005-07-19
    3 Chemical and Physical Properties
    Molecular Weight 136.86 g/mol
    Molecular Formula C6H5ClMg
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count0
    Exact Mass g/mol
    Monoisotopic Mass g/mol
    Topological Polar Surface Area0
    Heavy Atom Count8
    Formal Charge0
    Complexity100
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count3
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