Cas no 494764-96-4 (3-Octen-1-ol, 2,3,7-trimethyl-, (2S,3E)-)

3-Octen-1-ol, 2,3,7-trimethyl-, (2S,3E)- structure
494764-96-4 structure
Product Name:3-Octen-1-ol, 2,3,7-trimethyl-, (2S,3E)-
CAS No:494764-96-4
MF:C11H22O
MW:170.291783809662
CID:1533495
Update Time:2024-08-24

3-Octen-1-ol, 2,3,7-trimethyl-, (2S,3E)- Chemical and Physical Properties

Names and Identifiers

    • 3-Octen-1-ol, 2,3,7-trimethyl-, (2S,3E)-
    • Inchi: 1S/C11H22O/c1-9(2)6-5-7-10(3)11(4)8-12/h7,9,11-12H,5-6,8H2,1-4H3/b10-7+/t11-/m1/s1
    • InChI Key: SZJQKZSKSOWUQX-PFEDMVJOSA-N
    • SMILES: C(O)[C@@H](C)/C(/C)=C/CCC(C)C

Computed Properties

  • Exact Mass: 170.16716

Experimental Properties

  • Density: 0.843±0.06 g/cm3(Predicted)
  • Boiling Point: 237.6±9.0 °C(Predicted)
  • PSA: 20.23
  • pka: 14.94±0.10(Predicted)
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