Cas no 108673-17-2 (Ethanone,1-[4-[(1R)-1-hydroxyethyl]phenyl]-)

Ethanone,1-[4-[(1R)-1-hydroxyethyl]phenyl]- structure
108673-17-2 structure
Product Name:Ethanone,1-[4-[(1R)-1-hydroxyethyl]phenyl]-
CAS No:108673-17-2
MF:C10H12O2
MW:164.201083183289
CID:128116
PubChem ID:12588095
Update Time:2025-04-18

Ethanone,1-[4-[(1R)-1-hydroxyethyl]phenyl]- Chemical and Physical Properties

Names and Identifiers

    • Ethanone,1-[4-[(1R)-1-hydroxyethyl]phenyl]-
    • (R,S)-4'-(1-hydroxyethyl)acetophenone
    • Ethanone, 1-[4-[(1R)-1-hydroxyethyl]phenyl]- (9CI)
    • SCHEMBL17319344
    • 108673-17-2
    • 1-[4-[(1R)-1-hydroxyethyl]phenyl]ethanone
    • Inchi: 1S/C10H12O2/c1-7(11)9-3-5-10(6-4-9)8(2)12/h3-7,11H,1-2H3/t7-/m1/s1
    • InChI Key: NWDDTMPWTLSMBS-SSDOTTSWSA-N
    • SMILES: O[C@H](C)C1C=CC(C(C)=O)=CC=1

Computed Properties

  • Exact Mass: 164.08376
  • Monoisotopic Mass: 164.083729621g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 157
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.3
  • Topological Polar Surface Area: 37.3?2

Experimental Properties

  • PSA: 37.3
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