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    Technical details about Tox21_300376, learn more about the structure, uses, toxicity, action, side effects and more

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    Tox21_300376

    APIs // Active Pharmaceutical Ingredients

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    2D Structure
    Also known as: 1191-50-0, Sodium myristyl sulfate, Niaproof 4, Tetradecyl sodium sulfate, Texapon k 14, Tetradecyl sulfate sodium salt
    Molecular Formula
    C14H29NaO4S
    Molecular Weight
    316.43  g/mol
    InChI Key
    UPUIQOIQVMNQAP-UHFFFAOYSA-M
    FDA UNII
    2X50FW96YS
    An anionic surface-active agent used for its wetting properties in industry and used in medicine as an irritant and sclerosing agent for hemorrhoids and varicose veins.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    sodium;tetradecyl sulfate
    2.1.2 InChI
    InChI=1S/C14H30O4S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-19(15,16)17;/h2-14H2,1H3,(H,15,16,17);/q;+1/p-1
    2.1.3 InChI Key
    UPUIQOIQVMNQAP-UHFFFAOYSA-M
    2.1.4 Canonical SMILES
    CCCCCCCCCCCCCCOS(=O)(=O)[O-].[Na+]
    2.2 Other Identifiers
    2.2.1 UNII
    2X50FW96YS
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Sotradecol

    2. Sotradecol Sodium

    3. Sulfate, Sodium Tetradecyl

    4. Tergitol 4

    5. Tetradecyl Sulfate, Sodium

    6. Trombavar

    7. Trombovar

    2.3.2 Depositor-Supplied Synonyms

    1. 1191-50-0

    2. Sodium Myristyl Sulfate

    3. Niaproof 4

    4. Tetradecyl Sodium Sulfate

    5. Texapon K 14

    6. Tetradecyl Sulfate Sodium Salt

    7. Myristyl Sulfate, Sodium Salt

    8. Tetradecyl Sulfate, Sodium Salt

    9. Monotetradecylsulfate Sodium Salt

    10. Sodium 1-tetradecyl Sulfate

    11. Tetradecyl Sulfate (sodium)

    12. 2x50fw96ys

    13. 1-tetradecanol, 1-(hydrogen Sulfate), Sodium Salt (1:1)

    14. Tesapon K 14

    15. Natri Tetradecylsulfas

    16. Sodium Myristyl Sulphate

    17. Natrii Tetradecyclis Sulfas

    18. Tetradecilsulfato Sodico [inn-spanish]

    19. Natrii Tetradecyclis Sulfas [inn-latin]

    20. Sulfuric Acid, Myristyl Ester, Sodium Salt

    21. Tetradecyl Sulfate De Sodium [inn-french]

    22. Nsc-139032

    23. Sodium;tetradecyl Sulfate

    24. Einecs 214-737-2

    25. Sulfuric Acid, Monotetradecyl Ester, Sodium Salt

    26. Nsc 139032

    27. 1-tetradecanol, Hydrogen Sulfate Sodium Salt

    28. Unii-2x50fw96ys

    29. Mfcd00007468

    30. Sodiumtetradecylsulfate

    31. Dsstox_cid_8726

    32. Sodium N-tetradecyl Sulfate

    33. Sodium N-tetradecyl Sulphate

    34. Dsstox_rid_80017

    35. Dsstox_gsid_42416

    36. Schembl28992

    37. Chembl541505

    38. Dtxsid4042416

    39. Tox21_300376

    40. Tetradecyl Sulfate Sodium Salt, 95%

    41. Akos015912587

    42. Sodium Myristyl Sulfate [inci]

    43. Hy-w195048

    44. Ncgc00254331-01

    45. As-69862

    46. Cas-1191-50-0

    47. Db-041447

    48. Cs-0356213

    49. Ft-0633445

    50. E85523

    51. J-004075

    52. 1-tetradecanol, Hydrogen Sulphate Sodium Salt

    53. Q27255739

    54. 1-tetradecanol, 1-(hydrogen Sulphate), Sodium Salt (1:1)

    2.4 Create Date
    2008-02-05
    3 Chemical and Physical Properties
    Molecular Weight 316.43 g/mol
    Molecular Formula C14H29NaO4S
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count14
    Exact Mass316.16842486 g/mol
    Monoisotopic Mass316.16842486 g/mol
    Topological Polar Surface Area74.8 Ų
    Heavy Atom Count20
    Formal Charge0
    Complexity275
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Sclerosing Solutions

    Chemical agents injected into blood vessels and lymphatic sinuses to shrink or cause localized THROMBOSIS; FIBROSIS, and obliteration of the vessels. This treatment is applied in a number of conditions such as VARICOSE VEINS; HEMORRHOIDS; GASTRIC VARICES; ESOPHAGEAL VARICES; PEPTIC ULCER HEMORRHAGE. (See all compounds classified as Sclerosing Solutions.)

    Surface-Active Agents

    Agents that modify interfacial tension of water; usually substances that have one lipophilic and one hydrophilic group in the molecule; includes soaps, detergents, emulsifiers, dispersing and wetting agents, and several groups of antiseptics. (See all compounds classified as Surface-Active Agents.)

    4.2 ATC Code

    C - Cardiovascular system

    C05 - Vasoprotectives

    C05B - Antivaricose therapy

    C05BB - Sclerosing agents for local injection

    C05BB04 - Sodium tetradecyl sulfate

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