Cas no 5415-85-0 (Ethyl 2,3-diphenylpropanoate)

Ethyl 2,3-diphenylpropanoate structure
Ethyl 2,3-diphenylpropanoate structure
Product Name:Ethyl 2,3-diphenylpropanoate
CAS No:5415-85-0
MF:C17H18O2
MW:254.323625087738
CID:939934
PubChem ID:223571
Update Time:2025-04-19

Ethyl 2,3-diphenylpropanoate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 2,3-diphenylpropanoate
    • (+-)-2,3-Diphenyl-propionsaeure-aethylester
    • 2,3-diphenyl-propionic acid ethyl ester
    • 2,3-Diphenyl-propionsaeureaethylester
    • 2,3-Diphenyl-propionsaeure-aethylester
    • AC1L5CNT
    • AC1Q63XF
    • AG-J-85412
    • AR-1I8150
    • CTK4J9838
    • ethyl 2,3-diphenylpropionate
    • Ethyl-2,3-diphenylpropanoat
    • NSC11308
    • NSC-11308
    • 5415-85-0
    • SCHEMBL15553196
    • DTXSID00279118
    • Inchi: 1S/C17H18O2/c1-2-19-17(18)16(15-11-7-4-8-12-15)13-14-9-5-3-6-10-14/h3-12,16H,2,13H2,1H3
    • InChI Key: BBMUBGMOPJQRKA-UHFFFAOYSA-N
    • SMILES: O(CC)C(C(C1C=CC=CC=1)CC1C=CC=CC=1)=O

Computed Properties

  • Exact Mass: 254.13074
  • Monoisotopic Mass: 254.131
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 6
  • Complexity: 262
  • 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: 4.1
  • Topological Polar Surface Area: 26.3?2

Experimental Properties

  • Density: 1.074
  • Boiling Point: 339.8°C at 760 mmHg
  • Flash Point: 123.1°C
  • Refractive Index: 1.554
  • PSA: 26.3
  • LogP: 3.57600
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