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    Technical details about 4-Chloro-M-Cresol Sodium Salt, learn more about the structure, uses, toxicity, action, side effects and more

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    4-Chloro-M-Cresol Sodium Salt

    PharmaCompass

    Farmhispania Group, a leading European CDMO in HPAPI Technologies & High Potency Fermentation.

    One Pharma aims to be one of the leading generic companies in Europe.

    2D Structure
    1. Also known as: 15733-22-9, Sodium p-chloro-m-cresol, 4-chloro-m-cresol sodium salt, Sodium;4-chloro-3-methylphenolate, 2-chloro-5-hydroxytoluene sodium salt, 343kva8y38
    Molecular Formula
    C7H6ClNaO
    Molecular Weight
    164.56  g/mol
    InChI Key
    DPHAGKRZIJHMNL-UHFFFAOYSA-M
    FDA UNII
    343KVA8Y38
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    sodium;4-chloro-3-methylphenolate
    2.1.2 InChI
    InChI=1S/C7H7ClO.Na/c1-5-4-6(9)2-3-7(5)8;/h2-4,9H,1H3;/q;+1/p-1
    2.1.3 InChI Key
    DPHAGKRZIJHMNL-UHFFFAOYSA-M
    2.1.4 Canonical SMILES
    CC1=C(C=CC(=C1)[O-])Cl.[Na+]
    2.2 Other Identifiers
    2.2.1 UNII
    343KVA8Y38
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 15733-22-9

    2. Sodium P-chloro-m-cresol

    3. 4-chloro-m-cresol Sodium Salt

    4. Sodium;4-chloro-3-methylphenolate

    5. 2-chloro-5-hydroxytoluene Sodium Salt

    6. 343kva8y38

    7. P-chloro-m-cresol Sodium Salt

    8. 3-methyl-4-chlorophenol, Sodium Salt

    9. Caswell No. 756

    10. Chlorocresol Sodium

    11. Phenol, 4-chloro-3-methyl-, Sodium Salt

    12. Sodium 4-chloro-3-methylphenolate

    13. Sodium 4-chloro-m-cresolate

    14. Unii-343kva8y38

    15. P-chloro-m-cresol, Sodium Salt

    16. Sodium 4-chloro-3-methylphenoxide

    17. Einecs 239-825-8

    18. Epa Pesticide Chemical Code 064205

    19. Phenol, 4-chloro-3-methyl-, Sodium Salt (1:1)

    20. Schembl2393522

    21. Dtxsid7035696

    22. Preventol Cmk Sodium Salt

    23. Sodium-4-chloro-3-methylphenolate

    24. Sodium 3-methyl-4-chlorophenolate

    25. 4-chloro-m-cresol, Sodium Salt

    26. Sodium P-chloro-m-cresol [inci]

    27. 1-phenyl-1-chloroethane Sodium Salt

    28. 2-chloro-5-hydroxytoluene Sodium Salt, Aldrichcpr

    29. W-110414

    30. Q27256325

    2.4 Create Date
    2008-02-05
    3 Chemical and Physical Properties
    Molecular Weight 164.56 g/mol
    Molecular Formula C7H6ClNaO
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count1
    Rotatable Bond Count0
    Exact Mass164.0004868 g/mol
    Monoisotopic Mass164.0004868 g/mol
    Topological Polar Surface Area23.1 Ų
    Heavy Atom Count10
    Formal Charge0
    Complexity99.6
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2
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