Cyclohexanecarboxylic acid, 4-tert.-butyl, methyl ester, (e)

• Formula: C₁₂H₂₂O₂
• Molecular weight: 198.3019
• IUPAC Standard InChI: InChI=1S/C12H22O2/c1-12(2,3)10-7-5-9(6-8-10)11(13)14-4/h9-10H,5-8H2,1-4H3 Copy

  
• IUPAC Standard InChIKey: BWJSSYBIZVGKBG-UHFFFAOYSA-N Copy
• Chemical structure:
  This structure is also available as a 2d Mol file
• Species with the same structure:
  • Methyl cyclohexanecarboxylate, 4-(1,1-dimethylethyl), # 1
• Stereoisomers:
  • Cyclohexanecarboxylic acid, 4-(1,1-dimethylethyl)-, methyl ester, trans-
  • cis-1-Tert-butyl-4-carbomethoxycyclohexane
• Other names: Methyl cyclohexanecarboxylate, 4-(1,1-dimethylethyl), # 2
• Information on this page:
  • Gas Chromatography
  • References
  • Notes
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Gas Chromatography

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

Kovats' RI, non-polar column, isothermal

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Kovats' RI, polar column, isothermal

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References

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Pascal, Heintz, et al., 1974
Pascal, J.C.; Heintz, M.; Druilhe, A.; Lefort, D., Relations entre structure chimique et grandeurs de rétention. III. Stéréoisomères cyclohexaniques, Chromatographia, 1974, 7, 5, 236-245, https://doi.org/10.1007/BF02321774 . [all data]

Notes

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• Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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