Cas no 61698-76-8 (Des(isopropylamino) Atenolol Diol)

Des(isopropylamino) Atenolol Diol structure
61698-76-8 structure
Product Name:Des(isopropylamino) Atenolol Diol
CAS No:61698-76-8
MF:C11H15NO4
MW:225.241103410721
CID:515155
PubChem ID:572441
Update Time:2025-04-19

Des(isopropylamino) Atenolol Diol Chemical and Physical Properties

Names and Identifiers

    • Benzeneacetamide,4-(2,3-dihydroxypropoxy)-
    • Des(isopropylamino) Atenolol Diol
    • 2-(4-(2,3-Dihydroxypropoxy)phenyl)acetamide
    • Benzeneacetamide,4-(2,3-dihydroxypropoxy)
    • 2-[4-(2,3-DIHYDROXYPROPOXY)PHENYL]ACETAMIDE
    • 2-[4-[(2RS)-2,3-Dihydroxypropoxy]phenyl]acetamide
    • CQOQCZLTCMUVMX-UHFFFAOYSA-N
    • 2-[4-[(2RS)-2,3-Dihydroxypropoxy]phenyl]acetamide; Atenolol Imp. B (EP); Atenolol Related Compound A; Atenolol Impurity B
    • SCHEMBL660231
    • Benzeneacetamide, 4-(2,3-dihydroxypropoxy)-
    • UNII-FEB0QT69BD
    • ATENOLOL IMPURITY B [EP IMPURITY]
    • AKOS027250798
    • FEB0QT69BD
    • Atenolol impurity A
    • Ppa-diol
    • Q27277947
    • 4-(2,3-Dihydroxypropoxy)phenyl acetamide
    • 4-(2',3'-Dihydroxypropoxy)phenylacetamide
    • 4-(2,3-Dihydroxypropoxy)benzeneacetamide
    • 2-(4-((2RS)-2,3-DIHYDROXYPROPOXY)PHENYL)ACETAMIDE
    • DB-227000
    • 2-[4-(2,3-Dihydroxypropoxy)phenyl]acetamide #
    • 61698-76-8
    • 4-(2,3-DIHYDROXYPROPOXY)BENZENEACETAMIDE, (+/-)-
    • Inchi: 1S/C11H15NO4/c12-11(15)5-8-1-3-10(4-2-8)16-7-9(14)6-13/h1-4,9,13-14H,5-7H2,(H2,12,15)
    • InChI Key: CQOQCZLTCMUVMX-UHFFFAOYSA-N
    • SMILES: O(C1C=CC(=CC=1)CC(N)=O)CC(CO)O

Computed Properties

  • Exact Mass: 225.10000
  • Monoisotopic Mass: 225.1
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 6
  • Complexity: 214
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: _0.9
  • Topological Polar Surface Area: 92.8A^2

Experimental Properties

  • Density: 1.283
  • Boiling Point: 523.7°C at 760 mmHg
  • Flash Point: 270.6°C
  • Refractive Index: 1.579
  • PSA: 92.78000
  • LogP: 0.14670

Des(isopropylamino) Atenolol Diol Security Information

  • Storage Condition:(BD305893)

Des(isopropylamino) Atenolol Diol Pricemore >>

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