Cas no 85068-49-1 (Phenol,2-ethoxy-, carbonate (2:1) (9CI))

Phenol,2-ethoxy-, carbonate (2:1) (9CI) structure
85068-49-1 structure
Product Name:Phenol,2-ethoxy-, carbonate (2:1) (9CI)
CAS No:85068-49-1
MF:C17H18O5
MW:302.321825504303
CID:734237
PubChem ID:3020321
Update Time:2025-04-19

Phenol,2-ethoxy-, carbonate (2:1) (9CI) Chemical and Physical Properties

Names and Identifiers

    • Phenol,2-ethoxy-, carbonate (2:1) (9CI)
    • bis(2-ethoxyphenyl) carbonate
    • GUETHOL CARBONATE [WHO-DD]
    • Bis-(2-ethoxyphenyl)carbonate
    • 671ZCC5B5M
    • Carbonic acid bis(2-ethoxyphenyl) ester
    • J309.654H
    • PHENOL, 2-ETHOXY-, CARBONATE (2:1)
    • DTXSID80234144
    • NS00038753
    • Q27264055
    • UNII-671ZCC5B5M
    • Guethol carbonate
    • SCHEMBL2380676
    • 85068-49-1
    • EINECS 285-309-0
    • GUETOL CARBONATE
    • Inchi: 1S/C17H18O5/c1-3-19-13-9-5-7-11-15(13)21-17(18)22-16-12-8-6-10-14(16)20-4-2/h5-12H,3-4H2,1-2H3
    • InChI Key: LTAICIIOZBYBTN-UHFFFAOYSA-N
    • SMILES: O(CC)C1C=CC=CC=1OC(=O)OC1C=CC=CC=1OCC

Computed Properties

  • Exact Mass: 302.115424
  • Monoisotopic Mass: 302.115424
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 8
  • Complexity: 303
  • 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: 4.1
  • Topological Polar Surface Area: 54

Experimental Properties

  • Density: 1.162
  • Boiling Point: 417.9°Cat760mmHg
  • Flash Point: 183.6°C
  • Refractive Index: 1.542
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