Cas no 102361-94-4 (Benzoyl chloride,4-cyano-2-methoxy-)

Benzoyl chloride,4-cyano-2-methoxy- structure
102361-94-4 structure
Product Name:Benzoyl chloride,4-cyano-2-methoxy-
CAS No:102361-94-4
MF:C9H6ClNO2
MW:195.602441310883
CID:125036
PubChem ID:22675049
Update Time:2025-04-18

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

Names and Identifiers

    • Benzoyl chloride,4-cyano-2-methoxy-
    • 4-cyano-2-methoxybenzoyl chloride
    • Benzoyl chloride, 4-cyano-2-methoxy- (9CI)
    • 2-Methoxy-4-cyanobenzoylchloride
    • 2-Methoxy-4-cyanobenzoyl chloride
    • SCHEMBL5653240
    • DTXSID70627521
    • SY353750
    • DEWXSDRXHYWIBP-UHFFFAOYSA-N
    • MFCD13174323
    • 102361-94-4
    • Inchi: 1S/C9H6ClNO2/c1-13-8-4-6(5-11)2-3-7(8)9(10)12/h2-4H,1H3
    • InChI Key: DEWXSDRXHYWIBP-UHFFFAOYSA-N
    • SMILES: ClC(C1C=CC(C#N)=CC=1OC)=O

Computed Properties

  • Exact Mass: 195.00878
  • Monoisotopic Mass: 195.0087061g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 245
  • 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: 2.1
  • Topological Polar Surface Area: 50.1?2

Experimental Properties

  • PSA: 50.09
  • LogP: 1.94588

Benzoyl chloride,4-cyano-2-methoxy- Pricemore >>

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