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    Chemistry

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    Also known as: 3-phenylpropyl carbamate, 673-31-4, Spantol, Ansepron, Proformiphen, Eirenal
    Molecular Formula
    C10H13NO2
    Molecular Weight
    179.22  g/mol
    InChI Key
    CAMYKONBWHRPDD-UHFFFAOYSA-N
    FDA UNII
    UJZ473TPS0
    Phenprobamate
    1 2D Structure

    Phenprobamate

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    3-phenylpropyl carbamate
    2.1.2 InChI
    InChI=1S/C10H13NO2/c11-10(12)13-8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H2,11,12)
    2.1.3 InChI Key
    CAMYKONBWHRPDD-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=CC=C(C=C1)CCCOC(=O)N
    2.2 Other Identifiers
    2.2.1 UNII
    UJZ473TPS0
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 3-phenylpropylcarbamate

    2. Gamaquil

    2.3.2 Depositor-Supplied Synonyms

    1. 3-phenylpropyl Carbamate

    2. 673-31-4

    3. Spantol

    4. Ansepron

    5. Proformiphen

    6. Eirenal

    7. Actiphan

    8. Actozine

    9. Extacol

    10. Nelaxan

    11. Palmita

    12. Qumamquil

    13. Tranquil

    14. Fenprobamato

    15. Benzenepropanol, Carbamate

    16. 3-phenyl-1-propanol Carbamate

    17. Carbamic Acid, 3-phenylpropyl Ester

    18. 1-carbamoyloxy-3-phenylpropane

    19. Hg 532

    20. Mh 532

    21. Phenoprobamate

    22. Gamaquil

    23. 1-propanol, 3-phenyl-, Carbamate

    24. Mh-532

    25. Nsc 44682

    26. Nsc 50538

    27. Carbamic Acid 3-phenylpropyl Ester

    28. Nsc-44682

    29. Nsc-50538

    30. Nsc-64270

    31. Ujz473tps0

    32. .gamma.-phenylpropyl Carbamate

    33. Mls001075792

    34. 1-propanol, Carbamate

    35. Ncgc00164589-01

    36. Smr000466378

    37. Wln: Zvo3r

    38. .gamma.-phenylpropylcarbamat

    39. Dsstox_cid_26464

    40. Dsstox_rid_81638

    41. Dsstox_gsid_46464

    42. Phenprobamatum

    43. Mh532

    44. Benzenepropanol Carbamate

    45. Gamma-phenylpropyl Carbamate

    46. Fenprobamato [inn-spanish]

    47. Phenprobamatum [inn-latin]

    48. Cas-673-31-4

    49. Gamma-phenylpropylcarbamat [german]

    50. Phenprobamate [inn:ban:dcf:jan]

    51. Gamma-phenylpropylcarbamat

    52. Einecs 211-606-1

    53. Nsc 64270

    54. Unii-ujz473tps0

    55. Brn 1959273

    56. Phenprobamat

    57. Quamaquil

    58. Spantol (tn)

    59. Phenprobamate (jan/inn)

    60. Phenprobamate [mi]

    61. Phenprobamate [inn]

    62. Phenprobamate [jan]

    63. Cid_4770

    64. Nciopen2_000174

    65. Mls000759511

    66. Mls001075579

    67. Mls001075598

    68. Mls001424080

    69. Phenprobamate [mart.]

    70. Schembl134496

    71. Phenprobamate [who-dd]

    72. Chembl1079576

    73. Dtxsid2046464

    74. Bdbm66801

    75. Chebi:31992

    76. Hms2051j03

    77. Hms2235c09

    78. Hms3369f14

    79. Hms3393j03

    80. Hms3715h22

    81. Nsc44682

    82. Nsc50538

    83. Nsc64270

    84. Zinc1676954

    85. Tox21_112215

    86. Mfcd00868163

    87. Akos006273141

    88. Tox21_112215_1

    89. Ccg-100915

    90. Db13354

    91. Ks-5236

    92. Nc00165

    93. Ncgc00164589-02

    94. Ac-32475

    95. Bp166013

    96. C76122

    97. D01824

    98. 673p314

    99. A835714

    100. Q7181402

    101. W-104719

    102. Brd-k22009844-001-09-1

    2.4 Create Date
    2005-03-25
    3 Chemical and Physical Properties
    Molecular Weight 179.22 g/mol
    Molecular Formula C10H13NO2
    XLogP32
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count5
    Exact Mass179.094628657 g/mol
    Monoisotopic Mass179.094628657 g/mol
    Topological Polar Surface Area52.3 Ų
    Heavy Atom Count13
    Formal Charge0
    Complexity153
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
    4 Pharmacology and Biochemistry
    4.1 ATC Code

    M - Musculo-skeletal system

    M03 - Muscle relaxants

    M03B - Muscle relaxants, centrally acting agents

    M03BA - Carbamic acid esters

    M03BA01 - Phenprobamate

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