Cas no 179554-20-2 (Benzaldehyde,3-hydroxy-2,6-dimethyl-)

Benzaldehyde,3-hydroxy-2,6-dimethyl- structure
179554-20-2 structure
Product Name:Benzaldehyde,3-hydroxy-2,6-dimethyl-
CAS No:179554-20-2
MF:C9H10O2
MW:150.174502849579
CID:113197
PubChem ID:21847012
Update Time:2025-04-18

Benzaldehyde,3-hydroxy-2,6-dimethyl- Chemical and Physical Properties

Names and Identifiers

    • Benzaldehyde,3-hydroxy-2,6-dimethyl-
    • 3-hydroxy-2,6-dimethylbenzaldehyde
    • Benzaldehyde, 3-hydroxy-2,6-dimethyl- (9CI)
    • DTXSID80618748
    • SCHEMBL3975489
    • 179554-20-2
    • Inchi: 1S/C9H10O2/c1-6-3-4-9(11)7(2)8(6)5-10/h3-5,11H,1-2H3
    • InChI Key: ALSLMZLSIBDVQU-UHFFFAOYSA-N
    • SMILES: OC1=CC=C(C)C(C=O)=C1C

Computed Properties

  • Exact Mass: 150.0681
  • Monoisotopic Mass: 150.068079557g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 145
  • 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: 1.8
  • Topological Polar Surface Area: 37.3?2

Experimental Properties

  • PSA: 37.3

Benzaldehyde,3-hydroxy-2,6-dimethyl- Pricemore >>

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