Cas no 72351-69-0 (2-Azetidinecarboxaldehyde, 1-(diphenylmethyl)-)

2-Azetidinecarboxaldehyde, 1-(diphenylmethyl)- structure
72351-69-0 structure
Product Name:2-Azetidinecarboxaldehyde, 1-(diphenylmethyl)-
CAS No:72351-69-0
MF:C17H17NO
MW:251.322984457016
CID:1754793
PubChem ID:12717145
Update Time:2025-04-21

2-Azetidinecarboxaldehyde, 1-(diphenylmethyl)- Chemical and Physical Properties

Names and Identifiers

    • 2-Azetidinecarboxaldehyde, 1-(diphenylmethyl)-
    • DTXSID801259018
    • 1-(Diphenylmethyl)-2-azetidinecarboxaldehyde
    • SCHEMBL11273735
    • 1-diphenylmethyl-2-formylazetidine
    • 1-benzhydrylazetidine-2-carbaldehyde
    • DQVVUDMJLNXXOC-UHFFFAOYSA-N
    • 72351-69-0
    • Inchi: 1S/C17H17NO/c19-13-16-11-12-18(16)17(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-10,13,16-17H,11-12H2
    • InChI Key: DQVVUDMJLNXXOC-UHFFFAOYSA-N
    • SMILES: O=CC1CCN1C(C1C=CC=CC=1)C1C=CC=CC=1

Computed Properties

  • Exact Mass: 251.13111
  • Monoisotopic Mass: 251.131014166g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 4
  • Complexity: 274
  • 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: 3.1
  • Topological Polar Surface Area: 20.3?2

Experimental Properties

  • PSA: 20.31
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