Cas no 91413-60-4 (Dicyclopentylmethyl carbonochloridate)

Dicyclopentylmethyl carbonochloridate structure
91413-60-4 structure
Product Name:Dicyclopentylmethyl carbonochloridate
CAS No:91413-60-4
MF:C12H19ClO2
MW:230.731063127518
CID:2813853
PubChem ID:13314699
Update Time:2025-04-21

Dicyclopentylmethyl carbonochloridate Chemical and Physical Properties

Names and Identifiers

    • 91413-60-4
    • Dicyclopentylmethyl carbonochloridate
    • SCHEMBL10926150
    • DTXSID40536494
    • Inchi: 1S/C12H19ClO2/c13-12(14)15-11(9-5-1-2-6-9)10-7-3-4-8-10/h9-11H,1-8H2
    • InChI Key: NNPKEEIMBNODPN-UHFFFAOYSA-N
    • SMILES: ClC(=O)OC(C1CCCC1)C1CCCC1

Computed Properties

  • Exact Mass: 230.1073575Da
  • Monoisotopic Mass: 230.1073575Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 4
  • Complexity: 202
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4.9
  • Topological Polar Surface Area: 26.3?2
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