Cas no 31898-14-3 (2,2'-(Adamantane-1,3-diyl)diacetyl chloride)

2,2'-(Adamantane-1,3-diyl)diacetyl chloride structure
31898-14-3 structure
Product Name:2,2'-(Adamantane-1,3-diyl)diacetyl chloride
CAS No:31898-14-3
MF:C14H18Cl2O2
MW:289.197522640228
CID:1029961
PubChem ID:12809362
Update Time:2025-04-20

2,2'-(Adamantane-1,3-diyl)diacetyl chloride Chemical and Physical Properties

Names and Identifiers

    • 2,2'-(Adamantane-1,3-diyl)diacetyl chloride
    • 1,3-ADAMANTANEDIACETYL DICHLORIDE
    • 2-[3-(2-chloro-2-oxoethyl)-1-adamantyl]acetyl chloride
    • Tricyclo[3.3.1.1(3,7)]decane-1,3-diacetyl dichloride
    • DTXSID50510422
    • 2-[3-(2-CHLORO-2-OXOETHYL)ADAMANTAN-1-YL]ACETYL CHLORIDE
    • DB-301027
    • SCHEMBL11577622
    • 2,2'-(Adamantane-1,3-diyl)diacetylchloride
    • 1,3-Adamantanedtacetyl dichloride
    • 2,2'-(Tricyclo[3.3.1.1~3,7~]decane-1,3-diyl)diacetyl chloride
    • 31898-14-3
    • Inchi: 1S/C14H18Cl2O2/c15-11(17)6-13-2-9-1-10(4-13)5-14(3-9,8-13)7-12(16)18/h9-10H,1-8H2
    • InChI Key: SNRBLHMEOQZIKA-UHFFFAOYSA-N
    • SMILES: ClC(CC12CC3CC(CC(CC(=O)Cl)(C3)C1)C2)=O

Computed Properties

  • Exact Mass: 288.06854
  • Monoisotopic Mass: 288.0683852g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 4
  • Complexity: 357
  • 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: 4.5
  • Topological Polar Surface Area: 34.1?2

Experimental Properties

  • Density: 1.307±0.06 g/cm3 (20 oC 760 Torr),
  • Solubility: Almost insoluble (0.095 g/l) (25 o C),
  • PSA: 34.14

2,2'-(Adamantane-1,3-diyl)diacetyl chloride Pricemore >>

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