Cas no 141-26-4 (7-Octenal,3,7-dimethyl-)

7-Octenal,3,7-dimethyl- structure
7-Octenal,3,7-dimethyl- structure
Product Name:7-Octenal,3,7-dimethyl-
CAS No:141-26-4
MF:C10H18O
MW:154.249323368073
CID:117304
PubChem ID:101628
Update Time:2025-04-18

7-Octenal,3,7-dimethyl- Chemical and Physical Properties

Names and Identifiers

    • 7-Octenal,3,7-dimethyl-
    • 3,7-dimethyloct-7-enal
    • 3,7-Dimethyl-7-octenal
    • Rhodinal
    • α-Citronellal
    • a-citronellal
    • NS00041414
    • alpha-Citronellal
    • 7-Octenal, 3,7-dimethyl-
    • DTXSID60873313
    • 141-26-4
    • KQZAHMIZMBERJX-UHFFFAOYSA-N
    • UNII-A02IC9965Z
    • EINECS 205-474-4
    • .ALPHA.-CITRONELLAL [MI]
    • .ALPHA.-CITRONELLAL
    • A02IC9965Z
    • SCHEMBL2769174
    • Q27273446
    • Inchi: 1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h8,10H,1,4-7H2,2-3H3
    • InChI Key: KQZAHMIZMBERJX-UHFFFAOYSA-N
    • SMILES: O=CCC(C)CCCC(=C)C

Computed Properties

  • Exact Mass: 154.13584
  • Monoisotopic Mass: 154.135765193g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 6
  • Complexity: 127
  • 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

  • Boiling Point: bp1.4 51°
  • Refractive Index: nD20 1.4410
  • PSA: 17.07
  • Specific Rotation: D20 +9.75°

7-Octenal,3,7-dimethyl- Related Literature

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