Cas no 51318-83-3 (Benzene,5-(4-bromo-2,6-dimethoxyphenoxy)-1,2,3-trimethoxy-)

Benzene,5-(4-bromo-2,6-dimethoxyphenoxy)-1,2,3-trimethoxy- structure
51318-83-3 structure
Product Name:Benzene,5-(4-bromo-2,6-dimethoxyphenoxy)-1,2,3-trimethoxy-
CAS No:51318-83-3
MF:C17H19BrO6
MW:399.233165025711
CID:379674
PubChem ID:314904
Update Time:2025-04-19

Benzene,5-(4-bromo-2,6-dimethoxyphenoxy)-1,2,3-trimethoxy- Chemical and Physical Properties

Names and Identifiers

    • Benzene,5-(4-bromo-2,6-dimethoxyphenoxy)-1,2,3-trimethoxy-
    • 5-bromo-1,3-dimethoxy-2-(3,4,5-trimethoxyphenoxy)benzene
    • AC1L7QKF
    • NSC237505
    • NSC-237505
    • DTXSID30311015
    • 51318-83-3
    • Inchi: 1S/C17H19BrO6/c1-19-12-6-10(18)7-13(20-2)17(12)24-11-8-14(21-3)16(23-5)15(9-11)22-4/h6-9H,1-5H3
    • InChI Key: SQDSFSHEZOMCBY-UHFFFAOYSA-N
    • SMILES: BrC1C=C(C(=C(C=1)OC)OC1C=C(C(=C(C=1)OC)OC)OC)OC

Computed Properties

  • Exact Mass: 398.03647
  • Monoisotopic Mass: 398.03650g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 7
  • Complexity: 343
  • 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: 55.4?2

Experimental Properties

  • PSA: 55.38
  • LogP: 4.28440
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