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plum damascone

Plum damascone is a fragrance compound with a strong floral plum rose scent, primarily used in perfumery for its distinct odor profile.

General Material Description

Plum damascone, also known as isodamascone (standard), is an organic ketone with the molecular formula C13H20O. It appears as a clear fragrance material notable for its high-intensity floral aroma characterized by plum and rose notes. This compound plays a significant role in perfumery as a fragrance ingredient, imparting complex floral and fruity aspects. Synonyms include 1-(2,4,4-trimethyl-1-cyclohex-2-enyl)but-2-en-1-one and iso damascone. It is a controlled-vocabulary linked chemical entity identified in PubChem. Plum damascone is synthetically derived and primarily used as a fragrance agent in cosmetic and personal care formulations.

Occurrence, Applicability & Potential Uses

Plum damascone does not occur naturally in significant amounts but is a synthetic aroma chemical extensively utilized in the fragrance industry. It is valued for its ability to evoke floral, plum, rose, and tobacco scent nuances, contributing to complexity in perfumes and scented products. According to the International Fragrance Association (IFRA) (Global), its use is regulated to ensure safe exposure levels in consumer formulations. Typical applications include fine fragrances, body care products, and household items where a durable floral plum scent is desired.

Physico-Chemical Properties Summary

Physicochemical attributes of plum damascone influence its formulation and handling in fragrance applications. This ketone exhibits moderate volatility with a boiling point near 266 to 267 °C at atmospheric pressure and a vapor pressure of approximately 0.008 mmHg at 25 °C, indicating low evaporation rate under ambient conditions. Its relative density ranges from 0.918 to 0.926 at 25 °C, and refractive index falls between 1.485 and 1.493 at 20 °C. The compound is soluble in alcohols but has negligible water solubility around 10.31 mg/L at 25 °C, affecting solubilization in aqueous media. The estimated logP value of 3.436 suggests moderate lipophilicity conducive to integration in oil-based systems. Stability is maintained under proper storage, avoiding heat and light, with a shelf life of at least 12 months.

FAQ

What is plum damascone and what are its main synonyms?
Plum damascone is a synthetic fragrance compound recognized for its strong floral plum rose odor. It is chemically named 1-(2,4,4-trimethyl-1-cyclohex-2-enyl)but-2-en-1-one and also known as isodamascone (standard) or iso damascone. This ketone is used primarily in perfumery and personal care products to impart distinctive aromatic qualities.
Where is plum damascone commonly used and how is it applied in fragrances?
Plum damascone is commonly employed in the fragrance industry to provide floral, plum, rose, and tobacco nuances in perfumes and scented products. It is incorporated in various formulations including fine fragrances, body lotions, and household care items. Due to its moderate volatility and solubility properties, it is typically dissolved in alcohol or oil bases to ensure effective scent delivery and substantivity.
What regulations and safety considerations apply to plum damascone?
Plum damascone is subject to safety standards set by the International Fragrance Association (IFRA) (Global), which restrict its concentration in finished products to minimize dermal sensitization risk. It has no classified hazards under OSHA’s Globally Harmonized System but requires controlled use levels, especially in leave-on cosmetics and lip products. Storage recommendations include keeping it in a cool, dry, well-sealed container protected from heat and light. Toxicity data indicate a relatively low acute oral toxicity, and no significant dermal or inhalation toxicity has been established.

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Other Information

General Material Information

Preferred name plum damascone
Trivial Name 1-(2,4,4-trimethyl-1-cyclohex-2-enyl)but-2-en-1-one
Short Description isodamascone (standard)
Formula C13 H20 O
CAS Number 70266-48-7
FDA UNII Search
Nikkaji Number J308.518J
xLogP3-AA 3.30 (est)
NMR Predictor External link
Synonyms
  • iso damascone (standard)
  • 1-(2,4,4-trimethyl-1-cyclohex-2-enyl)but-2-en-1-one
  • 1-(2,4,4-trimethyl-2-cyclohexen-1-yl)-2-buten-1-one

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 192.30160522461
Specific gravity @ 25 °C
Pounds per Gallon 7.639 to 7.705
Refractive Index 1.485 to 1.493 @ 20 °C
Boiling Point 266 to 267°C @ 760 mm Hg
Vapor Pressure 0.008 mmHg @ 25 °C
Vapor Density 6.7
Flash Point TCC Value 93.33 °C TCC
logP (o/w) 3.436 est
Shelf life 12 months (or longer if stored properly.)
Storage notes Store in cool, dry place in tightly sealed containers, protected from heat and light.
Solubility
alcohol Yes
water, 10.31 mg/L @ 25 °C (est) Yes
water No

Organoleptic Properties

Odor Type: Floral
floral, plum, rose
Odor strength high , recommend smelling in a 10.00 % solution or less
Substantivity 128 hour(s) at 100.00 %
General comment At 10.00 % in dipropylene glycol. floral plum rose

Potential Uses

Applications
Odor purposes Floral , Plum , Rose , Tobacco

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:
oral-rat LD50 6300 mg/kg

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
IFRA Critical Effect:
Dermal sensitization
View the IFRA Standard
View IFRA Standards Library for complete information.
Please review Amendment 49 IFRA documentation for complete information.
IFRA RESTRICTION LIMITS IN THE FINISHED PRODUCT (%):
Category 1: Products applied to the lips
0.0077 %
Category 2: Products applied to the axillae
0.0023 %
Category 3: Products applied to the face/body using fingertips
0.046 %
Category 4: Products related to fine fragrance
0.043 %
Category 5: Products applied to the face and body using the hands (palms), primarily leave-on
Category 5A: Body lotion products applied to the body using the hands (palms), primarily leave-on
0.011 %
Category 5B: Face moisturizer products applied to the face using the hands (palms), primarily leave-on
0.011 %
Category 5C: Hand cream products applied to the hands using the hands (palms), primarily leave-on
0.011 %
Category 5D: Baby Creams, baby Oils and baby talc
0.011 %
Category 6: Products with oral and lip exposure
0.025 %
Category 7: Products applied to the hair with some hand contact
Category 7A: Rinse-off products applied to the hair with some hand contact
0.088 %
Category 7B: Leave-on products applied to the hair with some hand contact
0.088 %
Category 8: Products with significant anogenital exposure
0.0045 %
Category 9: Products with body and hand exposure, primarily rinse off
0.084 %
Category 10: Household care products with mostly hand contact
Category 10A: Household care excluding aerosol products (excluding aerosol/spray products)
0.30 %
Category 10B: Household aerosol/spray products
0.30 %
Category 11: Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate
Category 11A: Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate without UV exposure
0.17 %
Category 11B: Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate with potential UV exposure
0.17 %
Category 12: Products not intended for direct skin contact, minimal or insignificant transfer to skin
No Restriction
Notes:
IFRA FLAVOR REQUIREMENTS:

Due to the possible ingestion of small amounts of fragrance ingredients from their use in products in Categories 1 and 6, materials must not only comply with IFRA Standards but must also be recognized as safe as a flavoring ingredient as defined by the IOFI Code of Practice (www.iofi.org). For more details see chapter 1 of the Guidance for the use of IFRA Standards.

use level in formulae for use in cosmetics:
0.0200 %
Dermal Systemic Exposure in Cosmetic Products:
0.0005 mg/kg/day (IFRA, 2002)
Recommendation for plum damascone flavor usage levels up to:
not for flavor use.

Safety references

EPI System: View
EPA Substance Registry Services (TSCA):70266-48-7
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :6438067
National Institute of Allergy and Infectious Diseases:Data
1-(2,4,4-trimethyl-1-cyclohex-2-enyl)but-2-en-1-one
Chemidplus:0033673711