Cas no 6329-65-3 (Trimethyl-[2-(1,5,6-trimethoxyphenanthren-4-yl)ethyl]azanium;chloride)

Trimethyl-[2-(1,5,6-trimethoxyphenanthren-4-yl)ethyl]azanium;chloride structure
6329-65-3 structure
Product Name:Trimethyl-[2-(1,5,6-trimethoxyphenanthren-4-yl)ethyl]azanium;chloride
CAS No:6329-65-3
MF:C22H28ClNO3
MW:389.915625572205
CID:1655435
PubChem ID:24185802
Update Time:2025-04-21

Trimethyl-[2-(1,5,6-trimethoxyphenanthren-4-yl)ethyl]azanium;chloride Chemical and Physical Properties

Names and Identifiers

    • trimethyl-[2-(1,5,6-trimethoxyphenanthren-4-yl)ethyl]azanium,chloride
    • chloride
    • trimethyl-[2-(1,5,6-trimethoxyphenanthren-4-yl)ethyl]azanium
    • NSC-43491
    • DTXSID90637147
    • 6329-65-3
    • NSC43491
    • N,N,N-Trimethyl-2-(1,5,6-trimethoxyphenanthren-4-yl)ethan-1-aminium chloride
    • Trimethyl-[2-(1,5,6-trimethoxyphenanthren-4-yl)ethyl]azanium;chloride
    • Inchi: 1S/C22H28NO3.ClH/c1-23(2,3)14-13-16-8-11-18(24-4)17-10-7-15-9-12-19(25-5)22(26-6)21(15)20(16)17;/h7-12H,13-14H2,1-6H3;1H/q+1;/p-1
    • InChI Key: UIDAQCGBHIJVLI-UHFFFAOYSA-M
    • SMILES: [Cl-].O(C)C1C=CC(=C2C=1C=CC1C=CC(=C(C2=1)OC)OC)CC[N+](C)(C)C

Computed Properties

  • Exact Mass: 354.20704
  • Monoisotopic Mass: 389.175771
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 27
  • Rotatable Bond Count: 6
  • Complexity: 449
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 27.7

Experimental Properties

  • Boiling Point: °Cat760mmHg
  • Flash Point: °C
  • PSA: 27.69

Trimethyl-[2-(1,5,6-trimethoxyphenanthren-4-yl)ethyl]azanium;chloride Related Literature

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