Cas no 834885-72-2 (Cyclopentanecarbonitrile, 2-ethyl-1-hydroxy-, (1S,2R)-)

Cyclopentanecarbonitrile, 2-ethyl-1-hydroxy-, (1S,2R)- structure
834885-72-2 structure
Product Name:Cyclopentanecarbonitrile, 2-ethyl-1-hydroxy-, (1S,2R)-
CAS No:834885-72-2
MF:C8H13NO
MW:139.194922208786
CID:670701
PubChem ID:71415298
Update Time:2025-04-19

Cyclopentanecarbonitrile, 2-ethyl-1-hydroxy-, (1S,2R)- Chemical and Physical Properties

Names and Identifiers

    • Cyclopentanecarbonitrile, 2-ethyl-1-hydroxy-, (1S,2R)-
    • 834885-72-2
    • DTXSID70834718
    • (1S,2R)-2-Ethyl-1-hydroxycyclopentane-1-carbonitrile
    • Inchi: 1S/C8H13NO/c1-2-7-4-3-5-8(7,10)6-9/h7,10H,2-5H2,1H3/t7-,8-/m1/s1
    • InChI Key: NHGNODKDUJBLTA-HTQZYQBOSA-N
    • SMILES: O[C@@]1(C#N)CCC[C@H]1CC

Computed Properties

  • Exact Mass: 139.099714038g/mol
  • Monoisotopic Mass: 139.099714038g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 169
  • 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: 1.2
  • Topological Polar Surface Area: 44?2
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