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Substance Name: Isomenthone
RN: 491-07-6
UNII: 9WZ3E2G6CL
InChIKey: NFLGAXVYCFJBMK-IUCAKERBSA-N

Note

  • From the essential oil of rose-scented geranium (Pelargonium spp.).

Classification Codes

  • Natural Product
  • Skin / Eye Irritant

Molecular Formula

  • C10-H18-O

Molecular Weight

  • 154.2512
 
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Names and Synonyms

Results Name

  • Isomenthone

Name of Substance

  • Isomenthone, (+/-)-

Synonyms

  • 1-Methyl-4-isopropyl-3-cyclohexanone, cis-
  • 2-Isopropyl-5-methyl-cyclohexanone
  • 4-07-00-00087 (Beilstein Handbook Reference)
  • 5-Methyl-2-(1-methylethyl)cyclohexanone
  • BRN 3195564
  • cis-Menthone
  • Cyclohexanone, 5-methyl-2-(1-methylethyl)-, (Z)-
  • Cyclohexanone, 5-methyl-2-(1-methylethyl)-, cis-
  • d,l-Isomenthone
  • EINECS 207-727-4
  • EINECS 253-295-5
  • FEMA No. 3460
  • Isomenthone
  • p-Menthan-3-one, cis-
  • UNII-9WZ3E2G6CL

Systematic Names

  • (1)-Isomenthone
  • Cyclohexanone, 5-methyl-2-(1-methylethyl)-, (2R,5R)-rel-
  • Cyclohexanone, 5-methyl-2-(1-methylethyl)-, cis-
  • Isomenthone
  • p-Menthan-3-one, (Z)-

Superlist Name

  • Isomenthone

Registry Numbers

CAS Registry Number

  • 491-07-6

FDA UNII

  • 9WZ3E2G6CL

Other Registry Number

  • 36977-92-1

System Generated Number

  • 0000491076

Structure Descriptors

InChI

InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-9H,4-6H2,1-3H3/t8-,9-/m0/s1

InChIKey

NFLGAXVYCFJBMK-IUCAKERBSA-N

Smiles

CC(C)[C@@H]1CC[C@H](C)CC1=O