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    Chemistry

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    Also known as: N-ethylethanamine, 109-89-7, N,n-diethylamine, Ethanamine, n-ethyl-, Diethamine, Diaethylamin
    Molecular Formula
    C4H11N
    Molecular Weight
    73.14  g/mol
    InChI Key
    HPNMFZURTQLUMO-UHFFFAOYSA-N
    FDA UNII
    B035PIS86W
    Diethylamine
    diethylamine is a natural product found in Vitis vinifera and Cannabis sativa with data available.
    1 2D Structure

    Diethylamine

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    N-ethylethanamine
    2.1.2 InChI
    InChI=1S/C4H11N/c1-3-5-4-2/h5H,3-4H2,1-2H3
    2.1.3 InChI Key
    HPNMFZURTQLUMO-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CCNCC
    2.2 Other Identifiers
    2.2.1 UNII
    B035PIS86W
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Diethylamine Acetate

    2. Diethylamine Hydrobromide

    3. Diethylamine Hydrochloride

    4. Diethylamine Perchlorate

    5. Diethylamine Phosphate (1:1)

    6. Diethylamine Sulfate

    7. Diethylamine Sulfite (1:1)

    2.3.2 Depositor-Supplied Synonyms

    1. N-ethylethanamine

    2. 109-89-7

    3. N,n-diethylamine

    4. Ethanamine, N-ethyl-

    5. Diethamine

    6. Diaethylamin

    7. Dwuetyloamina

    8. Dietilamina

    9. Diethyl Amine

    10. Diethyl-amine

    11. Et2nh

    12. (c2h5)2nh

    13. B035pis86w

    14. Chebi:85259

    15. Mfcd00009032

    16. Diethylamin

    17. N-ethyl-ethanamine

    18. Diaethylamin [german]

    19. Dietilamina [italian]

    20. Dwuetyloamina [polish]

    21. Ccris 4792

    22. Hsdb 524

    23. Einecs 203-716-3

    24. Un1154

    25. Dietylamine

    26. Unii-b035pis86w

    27. Di-ethylamine

    28. Ai3-24215

    29. N,n-diethyl Amine

    30. Diethylamine (dea)

    31. Diethylamine, 98%

    32. Diethylamine Anhydrous

    33. Diethylamine, Bioxtra

    34. Hnet2

    35. Diethylamine [mi]

    36. Dsstox_cid_1909

    37. Diethylamine [hsdb]

    38. Diethylamine [inci]

    39. Ec 203-716-3

    40. Diethylamine, >=99.5%

    41. Chembl1189

    42. Dsstox_rid_76397

    43. Dsstox_gsid_21909

    44. Diethylamine, Lr, >=99%

    45. (ch3ch2)2 Nh

    46. Diethylamine, P.a., 99.0%

    47. Dtxsid6021909

    48. Str00027

    49. Zinc1661184

    50. Tox21_202506

    51. Stl197470

    52. Diethylamine, For Synthesis, 99.0%

    53. Akos000269031

    54. Diethylamine 2000 Microg/ml In Water

    55. Un 1154

    56. Diethylamine, Purum, >=99.0% (gc)

    57. Ncgc00090709-01

    58. Ncgc00090709-02

    59. Ncgc00260055-01

    60. Cas-109-89-7

    61. Melphalan Impurity K [ep Impurity]

    62. Diethylamine, Saj First Grade, >=98.0%

    63. D0462

    64. Diethylamine [un1154] [flammable Liquid]

    65. Diethylamine, Saj Special Grade, >=99.0%

    66. Ft-0624870

    67. D89660

    68. Diethylamine, Puriss. P.a., >=99.5% (gc)

    69. Diethylamine, Purified By Redistillation, 99.5%

    70. Q414196

    71. J-002340

    72. J-520311

    73. 5-oxo-l-prolyl-l-glutaminyl-l-alpha-aspartyl-o-sulfo-l-tyrosyl-l-threonylglycyl-l-tryptophyl-l-methionyl-l-alpha-aspartyl-l-phenylalaninamiden-ethylethanamine (1/1)

    2.4 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 73.14 g/mol
    Molecular Formula C4H11N
    XLogP30.6
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count1
    Rotatable Bond Count2
    Exact Mass73.089149355 g/mol
    Monoisotopic Mass73.089149355 g/mol
    Topological Polar Surface Area12 Ų
    Heavy Atom Count5
    Formal Charge0
    Complexity11.1
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
    4 Drug and Medication Information
    4.1 Minimum/Potential Fatal Human Dose

    The estimated fatal dermal dose of diethylamine for a human is 20 g (300 mmol).

    Dreisbach RH, Robertson WO; Handbook of Poisoning: Prevention, Diagnosis, and Treatment. 12th ed. Appleton & Lange, Norwalk, CT. p. 212 (1987)

    API Reference Price

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    04-Jan-2021
    29-Oct-2024
    KGS
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