Cas no 52085-11-7 (4-Isopropoxysalicylaldehyde)

4-Isopropoxysalicylaldehyde structure
4-Isopropoxysalicylaldehyde structure
Product Name:4-Isopropoxysalicylaldehyde
CAS No:52085-11-7
MF:C10H12O3
MW:180.200483322144
MDL:MFCD08753660
CID:2083803
PubChem ID:14547168
Update Time:2025-04-21

4-Isopropoxysalicylaldehyde Chemical and Physical Properties

Names and Identifiers

    • 4-Isopropoxysalicylaldehyde
    • 2-Hydroxy-4-isopropoxybenzaldehyde
    • 2-hydroxy-4-iso-propyloxybenzaldehyde
    • 4-(1-methylethyloxy)salicylaldehyde
    • MFCD08753660
    • AKOS000295593
    • MB06708
    • DB-253205
    • SY027242
    • N10524
    • SCHEMBL6092112
    • 52085-11-7
    • 2-HYDROXY-4-(PROPAN-2-YLOXY)BENZALDEHYDE
    • 2-hydroxy-4-propan-2-yloxybenzaldehyde
    • CS-0453231
    • STL417233
    • CCA08511
    • Benzaldehyde, 2-hydroxy-4-(1-methylethoxy)-
    • MDL: MFCD08753660
    • Inchi: 1S/C10H12O3/c1-7(2)13-9-4-3-8(6-11)10(12)5-9/h3-7,12H,1-2H3
    • InChI Key: NXEOENJLPLWXCN-UHFFFAOYSA-N
    • SMILES: O(C1C=CC(C=O)=C(C=1)O)C(C)C

Computed Properties

  • Exact Mass: 180.07900
  • Monoisotopic Mass: 180.078644241g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 168
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.4
  • Topological Polar Surface Area: 46.5?2

Experimental Properties

  • PSA: 46.53000
  • LogP: 1.99190

4-Isopropoxysalicylaldehyde Pricemore >>

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