Cas no 84604-58-0 (Cyclopentanecarboxaldehyde,2-pentyl-)

Cyclopentanecarboxaldehyde,2-pentyl- structure
84604-58-0 structure
Product Name:Cyclopentanecarboxaldehyde,2-pentyl-
CAS No:84604-58-0
MF:C11H20O
MW:168.275903701782
CID:721460
PubChem ID:3019987
Update Time:2025-04-19

Cyclopentanecarboxaldehyde,2-pentyl- Chemical and Physical Properties

Names and Identifiers

    • Cyclopentanecarboxaldehyde,2-pentyl-
    • 2-pentylcyclopentane-1-carbaldehyde
    • 2-pentylcyclopentanecarbaldehyde
    • EINECS 283-339-9
    • DTXSID801004891
    • NS00061199
    • 84604-58-0
    • Inchi: 1S/C11H20O/c1-2-3-4-6-10-7-5-8-11(10)9-12/h9-11H,2-8H2,1H3
    • InChI Key: MHKAJZIRAYWAOI-UHFFFAOYSA-N
    • SMILES: O=CC1CCCC1CCCCC

Computed Properties

  • Exact Mass: 168.151
  • Monoisotopic Mass: 168.151
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 5
  • Complexity: 131
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.9
  • Topological Polar Surface Area: 17.1?2

Experimental Properties

  • Density: 0.922
  • Boiling Point: 233.7°C at 760 mmHg
  • Flash Point: 79.8°C
  • Refractive Index: 1.491

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