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

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    Barbital Sodium

    APIs // Active Pharmaceutical Ingredients

    PRICE INFORMATION

    INTERMEDIATES

    REF. STANDARDS & IMPURITIES

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    2D Structure
    1. Also known as: Sodium barbital, 144-02-5, Sodium 5,5-diethylbarbiturate, Barbitone sodium, Veronal sodium, Sodium barbitone
    Molecular Formula
    C8H11N2NaO3
    Molecular Weight
    206.17  g/mol
    InChI Key
    RGHFKWPGWBFQLN-UHFFFAOYSA-M
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    sodium;5,5-diethyl-4,6-dioxo-1H-pyrimidin-2-olate
    2.1.2 InChI
    InChI=1S/C8H12N2O3.Na/c1-3-8(4-2)5(11)9-7(13)10-6(8)12;/h3-4H2,1-2H3,(H2,9,10,11,12,13);/q;+1/p-1
    2.1.3 InChI Key
    RGHFKWPGWBFQLN-UHFFFAOYSA-M
    2.1.4 Canonical SMILES
    CCC1(C(=O)NC(=NC1=O)[O-])CC.[Na+]
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. Sodium Barbital

    2. 144-02-5

    3. Sodium 5,5-diethylbarbiturate

    4. Barbitone Sodium

    5. Veronal Sodium

    6. Sodium Barbitone

    7. Barbital, Sodium

    8. 5,5-diethylbarbituric Acid Sodium Salt

    9. Sodium 5,5-diethyl-4,6-dioxo-1,4,5,6-tetrahydropyrimidin-2-olate

    10. Sodium;5,5-diethyl-4,6-dioxo-1h-pyrimidin-2-olate

    11. Embinal

    12. Natrinal

    13. Nervoseton

    14. Soprinal

    15. Thyalone

    16. Sodium Veronal

    17. Barbital Soluble

    18. Soluble Barbital

    19. Barbital Na

    20. Barbitalum-natrium

    21. Sodium Malonylurea

    22. Sodium Ethylbarbital

    23. Sodium Derivative Of 5,5-diethylbarbituric Acid

    24. Barbital Sodico

    25. Diethylmalonylurea Sodium

    26. Natriumbarbitals

    27. Sodium Diethylbarbiturate

    28. Barbital Sodique

    29. Barbitale Sodico

    30. Natriumbarbitals [german]

    31. Barbitale Sodico [dcit]

    32. Diethylbarbiturate Monosodium

    33. Barbitalum Natricum

    34. 275l5m93qs

    35. Barbital Sodico [inn-spanish]

    36. Barbital Sodique [inn-french]

    37. Ccris 3065

    38. Barbitalum Natricum [inn-latin]

    39. Barbital, Sodium Deriv.

    40. Barbitone, Sodium Deriv.

    41. Einecs 205-613-9

    42. Barbital Sodium [inn:nf]

    43. Unii-275l5m93qs

    44. Ai3-02728

    45. 2,4,6(1h,3h,5h)-pyrimidinetrione, 5,5-diethyl-, Monosodium Salt

    46. 5,5-diethylbarbituric Acid Sodium Deriv.

    47. Dsstox_cid_128

    48. Dsstox_rid_75387

    49. Dsstox_gsid_20128

    50. Schembl236588

    51. Barbituric Acid, 5,5-diethyl-, Sodium Salt

    52. Dtxsid3020128

    53. Bcp17724

    54. Tox21_200862

    55. Akos005111158

    56. Akos015914161

    57. Ncgc00258416-01

    58. Cas-144-02-5

    59. 5,5-diethylbarbituric Acid Salt Sodium Salt

    60. B0002

    61. S-4460

    62. Q4078035

    63. Sodium 5,5-diethylbarbiturate, Purum, >=99.0% (nt)

    64. Sodium 5,5-diethylbarbiturate, Bioultra, >=99.0% (nt)

    65. Sodium 5,5-diethylbarbiturate, Puriss. P.a., >=99.0% (nt)

    66. Sodium 5,5-diethylbarbiturate, Saj Special Grade, >=98.0%

    2.3 Create Date
    2008-02-05
    3 Chemical and Physical Properties
    Molecular Weight 206.17 g/mol
    Molecular Formula C8H11N2NaO3
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count2
    Exact Mass206.06673650 g/mol
    Monoisotopic Mass206.06673650 g/mol
    Topological Polar Surface Area81.6 Ų
    Heavy Atom Count14
    Formal Charge0
    Complexity284
    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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