Cas no 68938-63-6 (Ethanol,2-[[3-chloro-4-[2-(4-nitrophenyl)diazenyl]phenyl]ethylamino]-)

Ethanol,2-[[3-chloro-4-[2-(4-nitrophenyl)diazenyl]phenyl]ethylamino]- structure
68938-63-6 structure
Product Name:Ethanol,2-[[3-chloro-4-[2-(4-nitrophenyl)diazenyl]phenyl]ethylamino]-
CAS No:68938-63-6
MF:C16H17ClN4O3
MW:348.784182310104
CID:521666
PubChem ID:111851
Update Time:2025-04-19

Ethanol,2-[[3-chloro-4-[2-(4-nitrophenyl)diazenyl]phenyl]ethylamino]- Chemical and Physical Properties

Names and Identifiers

    • Ethanol,2-[[3-chloro-4-[2-(4-nitrophenyl)diazenyl]phenyl]ethylamino]-
    • 2-[[3-chloro-4-[(4-nitrophenyl)azo]phenyl]ethylamino]ethanol
    • 2-((3-Chloro-4-((4-nitrophenyl)azo)phenyl)ethylamino)ethanol
    • 2-[{3-chloro-4-[(E)-(4-nitrophenyl)diazenyl]phenyl}(ethyl)amino]ethanol
    • Ethanol, 2-((3-chloro-4-((4-nitrophenyl)azo)phenyl)ethylamino)-
    • Ethanol, 2-((3-chloro-4-(2-(4-nitrophenyl)diazenyl)phenyl)ethylamino)-
    • NS00063202
    • Ethanol, 2-[[3-chloro-4-[2-(4-nitrophenyl)diazenyl]phenyl]ethylamino]-
    • EINECS 273-135-8
    • Ethanol, 2-[[3-chloro-4-[(4-nitrophenyl)azo]phenyl]ethylamino]-
    • DTXSID90887600
    • 68938-63-6
    • Inchi: 1S/C16H17ClN4O3/c1-2-20(9-10-22)14-7-8-16(15(17)11-14)19-18-12-3-5-13(6-4-12)21(23)24/h3-8,11,22H,2,9-10H2,1H3/b19-18+
    • InChI Key: FCCANCPXZRMTTF-VHEBQXMUSA-N
    • SMILES: ClC1=C(C=CC(=C1)N(CC)CCO)/N=N/C1C=CC(=CC=1)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 348.09911
  • Monoisotopic Mass: 348.0989181g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 6
  • Complexity: 424
  • 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
  • Topological Polar Surface Area: 94?2

Experimental Properties

  • PSA: 100.12
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