Cas no 58772-83-1 (7-Nonenal,4,8-dimethyl-)

7-Nonenal,4,8-dimethyl- structure
7-Nonenal,4,8-dimethyl- structure
Product Name:7-Nonenal,4,8-dimethyl-
CAS No:58772-83-1
MF:C11H20O
MW:168.275903701782
CID:369254
PubChem ID:100845
Update Time:2025-04-19

7-Nonenal,4,8-dimethyl- Chemical and Physical Properties

Names and Identifiers

    • 7-Nonenal,4,8-dimethyl-
    • 4,8-Dimethyl-7-nonenal
    • 4,8-dimethylnon-7-enal
    • 7-Nonenal, 4,8-dimethyl-
    • EINECS 261-436-7
    • DTXSID20886287
    • SCHEMBL11866536
    • DTXSID60275954
    • 122091-00-3
    • NS00052912
    • 58772-83-1
    • Inchi: 1S/C11H20O/c1-10(2)6-4-7-11(3)8-5-9-12/h6,9,11H,4-5,7-8H2,1-3H3
    • InChI Key: JYZBGRBGMXAFMK-UHFFFAOYSA-N
    • SMILES: O=CCCC(C)CC/C=C(\C)/C

Computed Properties

  • Exact Mass: 168.1515
  • Monoisotopic Mass: 168.151
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 6
  • Complexity: 143
  • 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: 3.3
  • Topological Polar Surface Area: 17.1?2

Experimental Properties

  • Density: 0.836
  • Boiling Point: 236.3°Cat760mmHg
  • Flash Point: 94.9°C
  • Refractive Index: 1.44
  • PSA: 17.07
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