Cas no 17755-17-8 (Phenol, 2,6-bis[(dimethylamino)methyl]-4-nonyl-)

Phenol, 2,6-bis[(dimethylamino)methyl]-4-nonyl- structure
17755-17-8 structure
Product Name:Phenol, 2,6-bis[(dimethylamino)methyl]-4-nonyl-
CAS No:17755-17-8
MF:C21H38N2O
MW:334.539226055145
CID:96198
PubChem ID:71353416
Update Time:2025-04-18

Phenol, 2,6-bis[(dimethylamino)methyl]-4-nonyl- Chemical and Physical Properties

Names and Identifiers

    • Phenol, 2,6-bis[(dimethylamino)methyl]-4-nonyl-
    • 2,6-bis[(dimethylamino)methyl]-4-nonylphenol
    • DTXSID10778162
    • 2,6-bis(dimethylaminomethyl)-4-nonylphenol
    • 17755-17-8
    • Inchi: 1S/C21H38N2O/c1-6-7-8-9-10-11-12-13-18-14-19(16-22(2)3)21(24)20(15-18)17-23(4)5/h14-15,24H,6-13,16-17H2,1-5H3
    • InChI Key: NNURPGZOGPWGMS-UHFFFAOYSA-N
    • SMILES: OC1=C(CN(C)C)C=C(C=C1CN(C)C)CCCCCCCCC

Computed Properties

  • Exact Mass: 334.29864
  • Monoisotopic Mass: 334.298413840g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 12
  • Complexity: 286
  • 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: 5.8
  • Topological Polar Surface Area: 26.7?2

Experimental Properties

  • PSA: 26.71
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