Cas no 733741-06-5 ( )

  structure
  structure
Product Name: 
CAS No:733741-06-5
MF:C13H13FO3
MW:236.238927602768
CID:868423
PubChem ID:24722400
Update Time:2025-04-19

  Chemical and Physical Properties

Names and Identifiers

    • LogP
    • trans-2-(4-Fluorobenzoyl)cyclopentane-1-carboxylic acid
    • TRANS-2-(4-FLUOROBENZOYL)CYCLOPENTANE-1-CARBOXYLICACID
    • MFCD01311205
    • 733741-06-5
    • (1R,2R)-2-(4-Fluorobenzoyl)cyclopentane-1-carboxylic acid
    • DTXSID20641333
    • AKOS016017482
    •  
    • MDL: MFCD01311205
    • Inchi: 1S/C13H13FO3/c14-9-6-4-8(5-7-9)12(15)10-2-1-3-11(10)13(16)17/h4-7,10-11H,1-3H2,(H,16,17)/t10-,11-/m1/s1
    • InChI Key: NHQQJKKAHSUBRB-GHMZBOCLSA-N
    • SMILES: FC1C=CC(=CC=1)C([C@@H]1CCC[C@H]1C(=O)O)=O

Computed Properties

  • Exact Mass: 236.08487243g/mol
  • Monoisotopic Mass: 236.08487243g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 3
  • Complexity: 308
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 2
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.2
  • Topological Polar Surface Area: 54.4?2

  Pricemore >>

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A2B Chem LLC
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trans-2-(4-Fluorobenzoyl)cyclopentane-1-carboxylic acid
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