Cas no 111137-27-0 (Oxiraneacetic acid, octyl ester, (S)-)

Oxiraneacetic acid, octyl ester, (S)- structure
111137-27-0 structure
Product Name:Oxiraneacetic acid, octyl ester, (S)-
CAS No:111137-27-0
MF:C12H22O3
MW:214.301284313202
CID:1196610
Update Time:2024-08-02

Oxiraneacetic acid, octyl ester, (S)- Chemical and Physical Properties

Names and Identifiers

    • Oxiraneacetic acid, octyl ester, (S)-
    • 2-Oxiraneacetic acid, octyl ester, (2S)-
    • Inchi: 1S/C12H22O3/c1-2-3-4-5-6-7-8-14-12(13)9-11-10-15-11/h11H,2-10H2,1H3/t11-/m0/s1
    • InChI Key: FMDHLQZTPKEXPR-NSHDSACASA-N
    • SMILES: O1C[C@@H]1CC(OCCCCCCCC)=O

Computed Properties

  • Exact Mass: 214.15696

Experimental Properties

  • Density: 0.985±0.06 g/cm3(Predicted)
  • Boiling Point: 278.2±13.0 °C(Predicted)
  • PSA: 38.83
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