Cas no 46021-27-6 (1,2-Cyclohexanedicarbonyl dichloride, trans-(-)- (9CI))

1,2-Cyclohexanedicarbonyl dichloride, trans-(-)- (9CI) structure
46021-27-6 structure
Product Name:1,2-Cyclohexanedicarbonyl dichloride, trans-(-)- (9CI)
CAS No:46021-27-6
MF:C8H10Cl2O2
MW:209.069800853729
CID:325498
PubChem ID:57358125
Update Time:2025-04-19

1,2-Cyclohexanedicarbonyl dichloride, trans-(-)- (9CI) Chemical and Physical Properties

Names and Identifiers

    • 1,2-Cyclohexanedicarbonyl dichloride, trans-(-)- (9CI)
    • 46021-27-6
    • SCHEMBL11199858
    • DTXSID20724019
    • (1S,2S)-Cyclohexane-1,2-dicarbonyl dichloride
    • Inchi: 1S/C8H10Cl2O2/c9-7(11)5-3-1-2-4-6(5)8(10)12/h5-6H,1-4H2/t5-,6-/m0/s1
    • InChI Key: YKZFIPRBWVEQBE-WDSKDSINSA-N
    • SMILES: ClC([C@H]1CCCC[C@@H]1C(=O)Cl)=O

Computed Properties

  • Exact Mass: 208.0057849g/mol
  • Monoisotopic Mass: 208.0057849g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 181
  • 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: 2.8
  • Topological Polar Surface Area: 34.1?2
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