Cas no 101055-79-2 (1,4-Methanopentalene-2-carbonyl chloride, octahydro- (9CI))

1,4-Methanopentalene-2-carbonyl chloride, octahydro- (9CI) structure
101055-79-2 structure
Product Name:1,4-Methanopentalene-2-carbonyl chloride, octahydro- (9CI)
CAS No:101055-79-2
MF:C10H13ClO
MW:184.662622213364
CID:124452
PubChem ID:45081563
Update Time:2025-04-18

1,4-Methanopentalene-2-carbonyl chloride, octahydro- (9CI) Chemical and Physical Properties

Names and Identifiers

    • 1,4-Methanopentalene-2-carbonyl chloride, octahydro- (9CI)
    • 1,4-Methanopentalene-2-carbonylchloride, octahydro-
    • 5-Chlortricyclo[4.3.0.03,7]nonan
    • 5-Chlortricyclo< 4.3.0.03,7> nonan
    • ACMC-20m442
    • AG-D-07319
    • CTK0H2374
    • 101055-79-2
    • 1,4-Methanopentalene-2-carbonyl chloride,octahydro-(9ci)
    • DTXSID50664691
    • Octahydro-1,4-methanopentalene-2-carbonyl chloride
    • Inchi: 1S/C10H13ClO/c11-10(12)9-4-7-5-1-2-6(7)8(9)3-5/h5-9H,1-4H2
    • InChI Key: PYUSRMWVTGYHQJ-UHFFFAOYSA-N
    • SMILES: ClC(C1CC2C3CCC2C1C3)=O

Computed Properties

  • Exact Mass: 184.06559
  • Monoisotopic Mass: 184.065
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 238
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 5
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 17.1A^2
  • XLogP3: 3.1

Experimental Properties

  • PSA: 17.07
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