(1R,3S,4S,5S)-1-Isopropyl-4-methylbicyclo[3.1.0]hexan-3-yl acetate-rel-

• Formula: C₁₂H₂₀O₂
• Molecular weight: 196.2860
• IUPAC Standard InChI: InChI=1S/C12H20O2/c1-7(2)12-5-10(12)8(3)11(6-12)14-9(4)13/h7-8,10-11H,5-6H2,1-4H3 Copy

  
• IUPAC Standard InChIKey: RYMWIDNPMDLHRP-UHFFFAOYSA-N Copy
• CAS Registry Number: 370557-87-2
• Chemical structure:
  This structure is also available as a 2d Mol file
• Species with the same structure:
  • (1R,3R,4R,5S)-1-Isopropyl-4-methylbicyclo[3.1.0]hexan-3-yl acetate-rel-
  • (1R,3S,4R,5S)-1-Isopropyl-4-methylbicyclo[3.1.0]hexan-3-yl acetate-rel-
  • (1R,3R,4S,5S)-1-Isopropyl-4-methylbicyclo[3.1.0]hexan-3-yl acetate-rel
  • Thujyl acetate
  • neo-3-thujyl acetate
• Stereoisomers:
  • 3-Isothujyl acetate
  • neo-iso-3-Thujyl acetate
• Other names: Bicyclo[3.1.0]hexan-3-ol, 4-methyl-1-(1-methylethyl)-, 3-acetate, (1R,3S,4S,5S)-rel-; Bicyclo[3.1.0]hexan-3-ol, 4-methyl-1-(1-methylethyl)-, acetate, (1R,3S,4S,5S)-rel-; Neothujyl acetate; Neo-3-thujyl acetate
• Information on this page:
  • Notes
• Other data available:
  • Gas Chromatography
• Options:
  • Switch to calorie-based units

Notes

Go To: Top

• Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
• The National Institute of Standards and Technology (NIST) uses its best efforts to deliver a high quality copy of the Database and to verify that the data contained therein have been selected on the basis of sound scientific judgment. However, NIST makes no warranties to that effect, and NIST shall not be liable for any damage that may result from errors or omissions in the Database.
• Customer support for NIST Standard Reference Data products.