Cas no 40309-49-7 (3-hydroxy-5-methylhexanoic acid)

3-hydroxy-5-methylhexanoic acid structure
40309-49-7 structure
Product Name:3-hydroxy-5-methylhexanoic acid
CAS No:40309-49-7
MF:C7H14O3
MW:146.184262752533
MDL:MFCD16300811
CID:331588
PubChem ID:193804
Update Time:2025-11-06

3-hydroxy-5-methylhexanoic acid Chemical and Physical Properties

Names and Identifiers

    • Hexanoic acid,3-hydroxy-5-methyl-
    • 3-hydroxy-5-methylhexanoic acid
    • 3-hydroxy-5-methyl-hexanoic acid
    • 40309-49-7
    • NS-01119
    • 3-Hydroxyisoheptanoic acid
    • SCHEMBL667024
    • D96477
    • MFCD16300811
    • AKOS011682376
    • 3-Hydroxyisoheptanoate
    • NS00125235
    • EN300-1296859
    • DTXSID80865992
    • 3-Hydroxy-5-methylhexanoate
    • CHEBI:165406
    • Hexanoic acid, 3-hydroxy-5-methyl-
    • MDL: MFCD16300811
    • Inchi: 1S/C7H14O3/c1-5(2)3-6(8)4-7(9)10/h5-6,8H,3-4H2,1-2H3,(H,9,10)
    • InChI Key: SCAWECGFPWPHAR-UHFFFAOYSA-N
    • SMILES: OC(CC(=O)O)CC(C)C

Computed Properties

  • Exact Mass: 146.094294304g/mol
  • Monoisotopic Mass: 146.094294304g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 4
  • Complexity: 109
  • 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
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 0.8
  • Topological Polar Surface Area: 57.5?2

3-hydroxy-5-methylhexanoic acid Pricemore >>

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