Cas no 28125-17-9 (Cyclohexaneacetic acid, 4-(1,1-dimethylethyl)-, methyl ester, trans-)

Cyclohexaneacetic acid, 4-(1,1-dimethylethyl)-, methyl ester, trans- structure
28125-17-9 structure
Product Name:Cyclohexaneacetic acid, 4-(1,1-dimethylethyl)-, methyl ester, trans-
CAS No:28125-17-9
MF:C13H24O2
MW:212.328464508057
CID:1433936
Update Time:2024-08-15

Cyclohexaneacetic acid, 4-(1,1-dimethylethyl)-, methyl ester, trans- Chemical and Physical Properties

Names and Identifiers

    • Cyclohexaneacetic acid, 4-(1,1-dimethylethyl)-, methyl ester, trans-
    • methyl trans-(4-t-butylcyclohexyl)acetate
    • Inchi: 1S/C13H24O2/c1-13(2,3)11-7-5-10(6-8-11)9-12(14)15-4/h10-11H,5-9H2,1-4H3/t10-,11-
    • InChI Key: QWPPRHRNHXITPD-XYPYZODXSA-N
    • SMILES: [C@@H]1(CC(OC)=O)CC[C@@H](C(C)(C)C)CC1

Computed Properties

  • Exact Mass: 212.17772

Experimental Properties

  • Density: 0.922±0.06 g/cm3(Predicted)
  • Boiling Point: 239.6±8.0 °C(Predicted)
  • PSA: 26.3
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