Cas no 377735-34-7 (2-Cyclopenten-1-one,4,5-dihydroxy-2-(1E)-1-propenyl-,(4R,5R)-rel-(9CI))

2-Cyclopenten-1-one,4,5-dihydroxy-2-(1E)-1-propenyl-,(4R,5R)-rel-(9CI) structure
377735-34-7 structure
Product Name:2-Cyclopenten-1-one,4,5-dihydroxy-2-(1E)-1-propenyl-,(4R,5R)-rel-(9CI)
CAS No:377735-34-7
MF:C8H10O3
MW:154.163202762604
CID:922603
PubChem ID:101345093
Update Time:2025-04-19

2-Cyclopenten-1-one,4,5-dihydroxy-2-(1E)-1-propenyl-,(4R,5R)-rel-(9CI) Chemical and Physical Properties

Names and Identifiers

    • 2-Cyclopenten-1-one,4,5-dihydroxy-2-(1E)-1-propenyl-,(4R,5R)-rel-(9CI)
    • DTXSID701165515
    • 377735-34-7
    • rel-(4R,5R)-4,5-Dihydroxy-2-(1E)-1-propen-1-yl-2-cyclopenten-1-one
    • Inchi: 1S/C8H10O3/c1-2-3-5-4-6(9)8(11)7(5)10/h2-4,6,8-9,11H,1H3
    • InChI Key: ZAGNSSSEBATPLU-UHFFFAOYSA-N
    • SMILES: CC=CC1C(=O)C(O)C(O)C=1

Computed Properties

  • Exact Mass: 154.062994177g/mol
  • Monoisotopic Mass: 154.062994177g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 228
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 2
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -0.1
  • Topological Polar Surface Area: 57.5?2
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