Cas no 94088-30-9 (Nonanal, 4-methyl-)

Nonanal, 4-methyl- structure
Nonanal, 4-methyl- structure
Product Name:Nonanal, 4-methyl-
CAS No:94088-30-9
MF:C10H20O
MW:156.265203475952
CID:808510
PubChem ID:3023476
Update Time:2025-09-18

Nonanal, 4-methyl- Chemical and Physical Properties

Names and Identifiers

    • Nonanal, 4-methyl-
    • 4-methylnonan-1-al
    • 4-methylnonanal
    • EINECS 302-029-7
    • NS00064343
    • DHBWTBZYMOTKID-UHFFFAOYSA-N
    • SCHEMBL1410356
    • 94088-30-9
    • DTXSID40916530
    • 4URL39XW4J
    • UNII-4URL39XW4J
    • A1-31710
    • 4-Methyl-nonanal
    • Inchi: 1S/C10H20O/c1-3-4-5-7-10(2)8-6-9-11/h9-10H,3-8H2,1-2H3
    • InChI Key: DHBWTBZYMOTKID-UHFFFAOYSA-N
    • SMILES: O=CCCC(C)CCCCC

Computed Properties

  • Exact Mass: 156.151415257g/mol
  • Monoisotopic Mass: 156.151415257g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 7
  • Complexity: 88.9
  • 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: 3.5
  • Topological Polar Surface Area: 17.1?2

Experimental Properties

  • Density: 0.8373 (estimate)
  • Melting Point: -6°C (estimate)
  • Boiling Point: 210.54°C (estimate)
  • Refractive Index: 1.4243 (estimate)

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