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    CAS-70-70-2

    BUILDING BLOCK

    MARKET PLACE

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 4'-hydroxypropiophenone, 70-70-2, 4-hydroxypropiophenone, 1-(4-hydroxyphenyl)propan-1-one, P-hydroxypropiophenone, Mepal
    Molecular Formula
    C9H10O2
    Molecular Weight
    150.17  g/mol
    InChI Key
    RARSHUDCJQSEFJ-UHFFFAOYSA-N
    FDA UNII
    X9952001TG
    mepal is a natural product found in Carya cathayensis, Hydnocarpus annamensis, and Plumeria rubra with data available.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1-(4-hydroxyphenyl)propan-1-one
    2.1.2 InChI
    InChI=1S/C9H10O2/c1-2-9(11)7-3-5-8(10)6-4-7/h3-6,10H,2H2,1H3
    2.1.3 InChI Key
    RARSHUDCJQSEFJ-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CCC(=O)C1=CC=C(C=C1)O
    2.2 Other Identifiers
    2.2.1 UNII
    X9952001TG
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 4-hydroxypropiophenone

    2. P-hydroxypropiophenone

    3. Para-hydroxypropiophenone

    2.3.2 Depositor-Supplied Synonyms

    1. 4'-hydroxypropiophenone

    2. 70-70-2

    3. 4-hydroxypropiophenone

    4. 1-(4-hydroxyphenyl)propan-1-one

    5. P-hydroxypropiophenone

    6. Mepal

    7. Paroxypropion

    8. Frenantol

    9. Frenohypon

    10. Profenone

    11. Proxiphenon

    12. Paroxon

    13. P-propiophenol

    14. P-propionylphenol

    15. 1-propanone, 1-(4-hydroxyphenyl)-

    16. Hypophenon

    17. Possipione

    18. Sterofenon

    19. Frenormon

    20. Hypostat

    21. Ibiopopp

    22. Frenon

    23. Bio-fren

    24. 4-propionylphenol

    25. P-oxypropiophenone

    26. 1-(4-hydroxyphenyl)-1-propanone

    27. Paraoxypropiophenone

    28. Usaf Ek-3302

    29. P-hydroxyphenyl-1-propanone

    30. Ethyl P-hydroxyphenyl Ketone

    31. H 365

    32. H-365

    33. 1-(p-hydroxyphenyl)-1-propanone

    34. Propiophenone, 4'-hydroxy-

    35. 1-(4-hydroxy-phenyl)-propan-1-one

    36. B-360

    37. Nsc-2834

    38. B 360

    39. Mfcd00002361

    40. Mls000069406

    41. Chembl312311

    42. Chebi:32352

    43. X9952001tg

    44. Paroxypropione (inn)

    45. Ncgc00018097-04

    46. Ncgc00018097-06

    47. Smr000059092

    48. Dsstox_cid_3426

    49. Wln: Qr Dv2

    50. Dsstox_rid_77023

    51. Paroxypropione [inn]

    52. Dsstox_gsid_23426

    53. P-hydroxypropiophenone (jan)

    54. Parossipropione

    55. Paroxypropionum

    56. Paroxipropiona

    57. Possipion

    58. Parossipropione [dcit]

    59. P-hydroxypropiophenone [jan]

    60. Paroxypropione [inn:dcf]

    61. Cas-70-70-2

    62. Paroxypropionum [inn-latin]

    63. Paroxipropiona [inn-spanish]

    64. Para-hydroxypropiophenone

    65. Nsc 2834

    66. Einecs 200-743-2

    67. Brn 0907511

    68. Ai3-03719

    69. P.o.p.

    70. Unii-x9952001tg

    71. 4-propanoylphenol

    72. P-hydroxypropiophenon

    73. Vanatone

    74. 4-hydroxypropiophenon

    75. 4-hydroxy Propiophenone

    76. 4`-hydroxypropiophenone

    77. 4'-hydroxy-propiophenone

    78. 4''-hydroxypropiophenone

    79. Opera_id_1001

    80. Paroxypropione [mi]

    81. Ethyl 4-hydroxyphenyl Ketone

    82. 4-08-00-00441 (beilstein Handbook Reference)

    83. Chlorhexidinedigluconate

    84. Schembl440470

    85. 4?-hydroxypropiophenone

    86. Paroxypropione [mart.]

    87. 4'-hydroxypropiophenone, 98%

    88. F1995-0235

    89. Zinc1890

    90. Paroxypropione [who-dd]

    91. Dtxsid8023426

    92. Nsc2834

    93. Hms2235g15

    94. Hms3264a14

    95. Hms3372e08

    96. Pharmakon1600-01506169

    97. 1-(4-hydroxyphenyl)-propan-1-one

    98. Bcp26379

    99. Hy-b1353

    100. Nsc33949

    101. Tox21_110822

    102. Ac7855

    103. Bbl011845

    104. Bdbm50177402

    105. Nsc-33949

    106. Nsc760386

    107. S5396

    108. Stk397478

    109. Akos000120374

    110. Tox21_110822_1

    111. Ccg-214030

    112. Cs-7973

    113. Nsc-760386

    114. Ncgc00018097-01

    115. Ncgc00018097-02

    116. Ncgc00018097-03

    117. Ncgc00018097-05

    118. Ncgc00022475-03

    119. Ncgc00022475-04

    120. Ac-10985

    121. As-12055

    122. Sy003666

    123. Ft-0618741

    124. H0299

    125. D01870

    126. 4 Inverted Exclamation Mark -hydroxypropiophenone

    127. Ab00384258_14

    128. Af-676/00077028

    129. Sr-01000002967

    130. Sr-01000002967-2

    131. W-104544

    132. Brd-k07441213-001-14-8

    133. Q19598411

    134. Z1250132262

    2.4 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 150.17 g/mol
    Molecular Formula C9H10O2
    XLogP32
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count2
    Exact Mass150.068079557 g/mol
    Monoisotopic Mass150.068079557 g/mol
    Topological Polar Surface Area37.3 Ų
    Heavy Atom Count11
    Formal Charge0
    Complexity135
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1