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dimyrcetol (IFF)

Dimyrcetol (IFF) is a fragrance compound known for its medium-strength citrus and fresh lime odor, used extensively in perfumery and personal care products.
Chemical Structure

General Material Description

Dimyrcetol (IFF), also known under numerous synonyms including 2,6-dimethyl-7-octen-2-ol and dihydromyrcenol, is a naturally occurring monoterpenoid alcohol used primarily as a fragrance ingredient. This compound possesses a molecular formula of C10H20O and manifests as a clear liquid in its pure form. It is characterized by a fresh, citrus-lime scent complemented by herbal and marine undertones, making it valuable in perfumery and personal care products. The chemical structure and properties of dimyrcetol are documented under PubChem CID 29096. Derived synthetically or isolated from essential oils, it demands appropriate storage conditions to maintain stability. It is commonly employed under the International Flavors & Fragrances (IFF) designation for consistent quality.

Occurrence, Applicability & Potential Uses

Dimyrcetol is found in trace amounts in natural essential oils where related terpene alcohols occur. It is widely utilized as a fragrance agent imparting citrus and lime notes. Its scent profile is particularly suited for fresh lime colognes, shampoos, soaps, detergents, and floral-fresh fragrances. Dimyrcetol's usage levels and safety in fragrance formulations comply with the IFRA Code of Practice (Global), where usage restrictions ensure consumer safety and product stability. Its moderate substantivity requires careful formulation to achieve desired scent longevity in diverse applications.

Physico-Chemical Properties Summary

Dimyrcetol exhibits physical characteristics favorable for fragrance formulation. It is a clear liquid with a moderate specific gravity ranging from 0.857 to 0.866 at 20–25 °C, and a refractive index between 1.434 and 1.439 at 20 °C. The compound possesses a vapor pressure of approximately 0.166 mmHg at 25 °C, contributing to its volatility and odor release. Its estimated log P value around 2.9 indicates moderate lipophilicity, facilitating solvent compatibility, especially in alcohol-based systems. Dimyrcetol has a flash point near 80 °C (176 °F), implying typical handling precautions. Solubility is confirmed in alcohol and estimated moderate in water (~252 mg/L at 25 °C). Proper storage in sealed containers protected from heat and light extends its shelf life beyond 36 months.

FAQ

What is dimyrcetol and what are its main characteristics?
Dimyrcetol is a monoterpenoid alcohol used primarily as a fragrance ingredient. It is characterized by a fresh, citrus-lime odor with herbal and marine nuances. Known chemically as 2,6-dimethyl-7-octen-2-ol, it appears as a clear liquid with moderate volatility and lipophilicity, making it suitable for incorporation into various scent formulations. It has several synonyms including dihydromyrcenol and myrcetol.
How is dimyrcetol applied and where is it commonly used?
Dimyrcetol is commonly used in fragrance formulations such as colognes, shampoos, soaps, detergents, and floral-fresh scent profiles. Its citrus and lime odor qualities provide fresh and uplifting notes. The compound’s moderate substantivity means it sustains fragrance presence for less than three hours when applied neat, so it is often blended with other agents to optimize longevity. It complies with international fragrance safety standards like IFRA (Global).
What regulations and safety considerations apply to dimyrcetol?
Dimyrcetol is subject to safety assessments under international guidelines such as IFRA (Global), which limit fragrance usage concentrations to 75% in concentrates and restrict its use in flavor applications. Toxicity data indicate low acute toxicity, with no hazardous statements under OSHA HCS classifications. Its handling involves normal precautions for fragrance chemicals, including storage in a cool, dry place away from heat and light to maintain stability. Safety data sheets are available for detailed information.

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Other Information

General Material Information

Preferred name dimyrcetol (IFF)
Trivial Name 2,6-Dimethyl-7-octen-2-ol
Short Description myrcetol
Formula C10 H20 O
CAS Number 18479-58-8
Deleted CAS Number 25279-08-7
ECHA Number 242-362-4
FDA UNII 46L1B02ND9
Beilstein Number 1840872
MDL MFCD00004474
xLogP3-AA 2.90 (est)
Bio Activity Summary External link
NMR Predictor External link
Synonyms
  • citrolime
  • dihydromyrcenyl formate + dihydromyrcenol
  • 2,6-dimethyl oct-7-en-2-yl formate + 2,6-dimethyl oct-7-en-2-ol
  • formyrcenol
  • lime octenol
  • myrcetol
  • 2,6-dimethyloct-7-en-2-ol
  • 7-Octen-2-ol, 2,6-dimethyl-
  • 2,6-Dimethyl-7-octen-2-ol
  • 3,7-Dimethyl-1-octen-7-ol
  • 1,1,5-Trimethyl-6-heptenol
  • Dihydromyrcenol

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 156.26860046387
Specific gravity @ 25 °C
Pounds per Gallon 7.131 to 7.198
Specific gravity @ 20 °C
Pounds per Gallon 7.148 to 7.214
Refractive Index 1.434 to 1.439 @ 20 °C
Vapor Pressure 0.166 mmHg @ 25 °C
Flash Point TCC Value 80 °C TCC
logP (o/w) 2.99
Shelf life 36 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, 252.2 mg/L @ 25 °C (est) Yes
water No

Organoleptic Properties

Odor Type: Citrus
fresh, lime, cologne, herbal, watery, marine
Odor strength medium
Substantivity < 3 hour(s) at 100.00 %
General comment At 100.00 %. fresh lime cologne herbal air marine
Used in colognes, shampoos, soaps, detergents, and floral-fresh types. Citrusy-floral and sweet

Potential Uses

Applications
Odor purposes Citrus , Lime

Safety Information

Safety information

Preferred SDS: View
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 3600 mg/kg
(Moreno, 1973o)

oral-rat LD50 3600 mg/kg
Food and Cosmetics Toxicology. Vol. 12, Pg. 525, 1974.

Dermal Toxicity:
skin-rabbit LD50 > 5000 mg/kg
Food and Cosmetics Toxicology. Vol. 12, Pg. 525, 1974.

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 dimyrcetol (IFF) usage levels up to:
75.0000 % in the fragrance concentrate.
Recommendation for dimyrcetol (IFF) 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):18479-58-8
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :29096
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:1
2,6-dimethyloct-7-en-2-ol
Chemidplus:0018479588
RTECS:RH3420000 for cas# 18479-58-8