Cas no 764663-53-8 (1-(1-Adamantylmethyl)piperazin-4-ium chloride)

1-(1-Adamantylmethyl)piperazin-4-ium chloride structure
764663-53-8 structure
Product Name:1-(1-Adamantylmethyl)piperazin-4-ium chloride
CAS No:764663-53-8
MF:C15H27ClN2
MW:270.841283082962
CID:982682
Update Time:2023-08-03

1-(1-Adamantylmethyl)piperazin-4-ium chloride Chemical and Physical Properties

Names and Identifiers

    • 1-(1-adamantylmethyl)piperazine,hydrochloride
    • 1-(1-ADAMANTYLMETHYL)PIPERAZIN-4-IUM CHLORIDE
    • (adamantanylmethyl)piperazine, chloride
    • ST50564807
    • 1-(1-ADAMANTYLMETHYL)PIPERAZINE HYDROCHLORIDE
    • 1-[(Tricyclo[3.3.1.1~3,7~]decan-1-yl)methyl]piperazine--hydrogen chloride (1/1)
    • 1-(1-Adamantylmethyl)piperazin-4-ium chloride
    • Inchi: 1S/C15H26N2.ClH/c1-3-17(4-2-16-1)11-15-8-12-5-13(9-15)7-14(6-12)10-15;/h12-14,16H,1-11H2;1H
    • InChI Key: KVTVAKMWFILJLE-UHFFFAOYSA-N
    • SMILES: Cl.N1(CCNCC1)CC12CC3CC(CC(C3)C1)C2

Computed Properties

  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 2
  • Complexity: 252
  • Topological Polar Surface Area: 15.3
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