Cas no 4686-99-1 (2,5-Bispropyloxybenzaldehyde)

2,5-Bispropyloxybenzaldehyde structure
2,5-Bispropyloxybenzaldehyde structure
Product Name:2,5-Bispropyloxybenzaldehyde
CAS No:4686-99-1
MF:C13H18O3
MW:222.280224323273
CID:2129127
Update Time:2023-08-04

2,5-Bispropyloxybenzaldehyde Chemical and Physical Properties

Names and Identifiers

    • 2,5-bispropyloxybenzaldehyde
    • 2,5-Bispropyloxybenzaldehyde
    • Inchi: 1S/C13H18O3/c1-3-7-15-12-5-6-13(16-8-4-2)11(9-12)10-14/h5-6,9-10H,3-4,7-8H2,1-2H3
    • InChI Key: NADIKWZQGLHOLY-UHFFFAOYSA-N
    • SMILES: O(CCC)C1C=CC(=CC=1C=O)OCCC

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 7
  • Complexity: 194
  • XLogP3: 3.1
  • Topological Polar Surface Area: 35.5
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