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    General Material Information
  2. 2.
    PhysChem Properties
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  4. 4.
    Organoleptic Properties
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clary octenone

Chemical Structure

General Material Information

Preferred name clary octenone
Trivial Name Claritone
Short Description claritone (Symrise)
Formula C12 H22 O
CAS Number 74338-72-0
FDA UNII Search
Nikkaji Number J1.977.540B
xLogP3-AA 3.80 (est)
NMR Predictor External link
Synonyms
  • claritone (Symrise)
  • 2,4,4,7-tetramethyl-6-octen-3-one
  • 2,4,4,7-tetramethyloct-6-en-3-one
  • 2,4,4,7-tetramethyloct-6-en-3-one
  • 6-Octen-3-one, 2,4,4,7-tetramethyl-
  • 2,4,4,7-Tetramethyl-6-octen-3-one
  • Claritone

US / EU / FDA / JECFA / FEMA / Scholar / Patents

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Other Information

(IUPAC):Atomic Weights of the Elements 2011 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
HMDB (The Human Metabolome Database):Search
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 182.30653381348
Specific gravity @ 25 °C
Pounds per Gallon 7.023 to 7.056
Refractive Index 1.444 to 1.45 @ 20 °C
Boiling Point 238 to 239°C @ 760 mm Hg
Vapor Pressure 0.01 mmHg @ 20 °C
Vapor Density 6.3
Flash Point TCC Value 78.89 °C TCC
logP (o/w) 3.67
Solubility
alcohol Yes
water, 28.12 mg/L @ 25 °C (est) Yes
water No

Organoleptic Properties

Odor Type: Herbal
sweet, herbal, sage clary sage, bergamot, petitgrain, tropical, citrus
Odor strength medium
Substantivity 5 hour(s) at 100.00 %
Luebke, William tgsc, (2009) At 100.00 %. sweet herbal clary sage bergamot petitgrain tropical citrus
Stable in: body lotion (good), shampoo (good), soap (very good), ap roll-on (good), powder (good), cleaner citric (good), cleaner apc (very good), bleach (poor). Fresh, green, citrus herbal top note with floral peony-like accents, reminiscent of the natural fruity freshness of grapefruit and clary sage oil
General comment Fresh, green, citrus herbal top note with floral peony-like accents, reminiscent of the natural fruity freshness of grapefruit and clary sage oil

Potential Uses

Applications
Odor purposes Agate , Agrumen aldehyde , Ajowan , Alpine bouquet , Angelica , Arnica flower , Ash mountain ash berry , Basil oil replacer , Bayberry , Bayberry , Blue grass , Cajeput , Calamus oil replacer , Camphor tree bark , Caraway seed , Carrot seed , Celery , Chamomile , Chrysanthemum , Cilantro , Clary sage oil replacer , Coriander , Country meadow , Cranberry , Cubeb , Currant bud absolute replacer , Cypress oil replacer , Deertongue absolute replacer , Dill weed , Elder flower , Eucalyptus oil replacer , Fennel , Fig , Flouve , Forest , Genet , Ginger white ginger , Gingergrass , Heather , Herbal , Hollyberry , Hop , Hyssop , Ivy , Lavandin , Lavender , Lavender flower , Lavender spike lavender , Lovage root , Marigold , Marjoram , Melissa oil replacer , Myrtle oil replacer , Niaouli , Oregano , Parsley leaf , Pine forest , Reseda , Rosemary , Rue , Saffron , Savin , Spruce , Sweet grass , Tansy oil replacer , Tea green tea , Thyme oil white replacer , Valerian , Witch hazel , Woodruff , Wormwood oil replacer , Yerba mate , Yew
Flavoring purposes Ajowan , Angelica , Cajeput , Camphor tree bark , Capsicum , Caraway seed , Carrot , Carrot seed , Chervil , Cilantro , Coriander , Cubeb , Currant bud absolute replacer , Dill weed , Gin , Hyssop , Lavender flower , Lavender spike lavender , Lovage root , Marigold , Marjoram , Parsley leaf , Rue , Savin , Tansy oil replacer , Tea , Tea black tea , Tea herbal tea , Tea lemon tea , Valerian , Yerba mate
Other purposes Parsnip , Tea china

Safety Information

Safety information

Hazards identification
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
Pictogram
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined

Safety in use information

Category:
fragrance agents
RIFM Fragrance Material Safety Assessment: Search
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
Recommendation for clary octenone usage levels up to:
8.0000 % in the fragrance concentrate.
Recommendation for clary octenone flavor usage levels up to:
not for flavor use.

Safety references

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):74338-72-0
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :9815427
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
2,4,4,7-tetramethyloct-6-en-3-one
Chemidplus:0074338720