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Home> Encyclopedia > Hot Product Listed 6   > 6,9-bis(hexadecyloxymethyl)-4,7-dioxanonane-1,2,9-triol
53994-83-5 structure

6,9-bis(hexadecyloxymethyl)-4,7-dioxanonane-1,2,9-triol

CAS No.:53994-83-5
Molecular Weight:369.78018
Molecular Formula:C8H12N2O (isomer)
Names and Identifiers
Synonyms

3-{3-(hexadecyloxy)-2-[3-(hexadecyloxy)-2-hydroxypropoxy]propoxy}propane-1,2-diol ACMC-20N35K AKOS030557667 CTK0H0732 DTXSID60700817 fkfhbbzkfodure-uhfffaoysa-n

Inchi
InChI=1/C14H12ClN3O5S/c15-9-6-24-13-10(16)12(19)17(13)11(9)14(20)23-5-7-1-3-8(4-2-7)18(21)22/h1-4,10,13H,5-6,16H2
Canonical Smiles
C1C(=C(N2C(S1)C(C2=O)N)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])Cl
Properties
Refractive Index
1.704
Computational chemical data
  • Molecular Weight:369.78018g/mol
  • Molecular Formula:C8H12N2O
  • Exact Mass:369.018619
  • Monoisotopic Mass:369.018619
  • Complexity:600
  • Rotatable Bond Count:4
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:7
  • Topological Polar Surface Area:144
  • Heavy Atom Count:24
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:2
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
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