Cas no 195507-73-4 (Benzoyl chloride,4-ethoxy-2-methoxy-)

Benzoyl chloride,4-ethoxy-2-methoxy- structure
195507-73-4 structure
Product Name:Benzoyl chloride,4-ethoxy-2-methoxy-
CAS No:195507-73-4
MF:C10H11ClO3
MW:214.645542383194
CID:116794
PubChem ID:18001082
Update Time:2025-04-18

Benzoyl chloride,4-ethoxy-2-methoxy- Chemical and Physical Properties

Names and Identifiers

    • Benzoyl chloride,4-ethoxy-2-methoxy-
    • 4-ethoxy-2-methoxybenzoyl chloride
    • Benzoyl chloride, 4-ethoxy-2-methoxy- (9CI)
    • 195507-73-4
    • DTXSID20592391
    • SCHEMBL7017038
    • Inchi: 1S/C10H11ClO3/c1-3-14-7-4-5-8(10(11)12)9(6-7)13-2/h4-6H,3H2,1-2H3
    • InChI Key: WYUJXCYKYPLTBL-UHFFFAOYSA-N
    • SMILES: ClC(C1C=CC(=CC=1OC)OCC)=O

Computed Properties

  • Exact Mass: 214.03973
  • Monoisotopic Mass: 214.0396719g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 4
  • Complexity: 196
  • 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: 2.6
  • Topological Polar Surface Area: 35.5?2

Experimental Properties

  • PSA: 35.53
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