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phenoxyacetaldehyde 50% in benzyl alcohol

Phenoxyacetaldehyde 50% in benzyl alcohol is a fragrance compound noted for its fresh green leafy and hyacinth odor, widely used in perfuming agents.
Chemical Structure

General Material Description

Phenoxyacetaldehyde, also referred to as cortex aldehyde or acetaldehyde, 2-phenoxy-, is an organic aromatic aldehyde with the molecular formula C8H8O2. It appears as a solution at 50% concentration in benzyl alcohol, a common solvent in fragrance formulations. This compound is characterized by a distinct green and leafy fragrance quality, often described as fresh and reminiscent of hyacinth or ozone. It is indexed under several synonyms including 2-phenoxyethanal and NSC 49355. Phenoxyacetaldehyde is sourced primarily for perfumery purposes where it contributes to fresh outdoors and floral accords. The compound is catalogued in chemical databases such as PubChem under CID 75033.

Occurrence, Applicability & Potential Uses

Phenoxyacetaldehyde occurs synthetically and is valued in fragrance creation for its green cortical, hyacinth, and leather notes. It serves as an important ingredient in perfuming agents and can be found in formulations aimed at achieving fresh, natural outdoor scents as well as floral and leafy nuances such as lily of the valley and grass. The compound's usage is governed by IFRA (Global) standards, which recommend usage levels up to 2.0000% in fragrance concentrates. While it is primarily a fragrance agent, it is not intended for flavor use. Its compatibility with benzyl alcohol improves its application as a stable and effective ingredient in cosmetic products.

Physico-Chemical Properties Summary

Phenoxyacetaldehyde exhibits specific physicochemical properties relevant to fragrance formulation. It has a moderate estimated log P value of 1.134, indicating balanced lipophilicity conducive to blending with typical cosmetic solvents. The specific gravity ranges narrowly from 1.12 to 1.14 at 25 °C, enabling consistent handling and dosing. Its refractive index between 1.545 and 1.565 at 20 °C helps in optical verification during analysis. The compound demonstrates low vapor pressure (0.113 mmHg at 25 °C), supporting moderate volatility essential for sustained fragrance release. It is soluble in alcohol and estimated to dissolve in water at about 10,480 mg/L at 25 °C, although insoluble in pure water, reflecting solvation dynamics influenced by the benzyl alcohol medium. The flash point is 185 °F (85 °C), indicating a relatively safe handling profile under typical conditions.

FAQ

What is phenoxyacetaldehyde and what are its primary characteristics?
Phenoxyacetaldehyde is an aromatic aldehyde commonly used in perfumery as a fragrance agent. It is usually supplied as a 50% solution in benzyl alcohol. The compound emits a medium-strength green, leafy odor reminiscent of cortex, hyacinth, and fresh outdoors. Chemically, it contains eight carbon atoms, eight hydrogens, and two oxygens, and is recognized for its distinct sensory profile that enhances fresh and natural scent compositions.
How is phenoxyacetaldehyde typically used and where does it occur biologically or industrially?
Phenoxyacetaldehyde is primarily obtained through synthetic processes rather than biological sources. Industrially, it is utilized as a perfuming agent in fragrances, contributing green, fresh, and floral notes such as hyacinth and lily of the valley. Its inclusion in fragrances conforms to international fragrance standards like those of IFRA (Global). The compound is formulated within fragrance concentrates up to recommended levels for safety and efficacy, generally dissolved in solvents like benzyl alcohol to improve stability and delivery.
What regulations and safety considerations apply to phenoxyacetaldehyde in fragrance use?
Phenoxyacetaldehyde usage is subject to guidelines provided by IFRA (Global), which recommend maximum use concentrations of 2.0000% in fragrance concentrates. There are no major hazard classifications under OSHA's hazard communication standards. The compound is not approved for flavor use. Safety data sheets indicate no significant hazard classifications or precautionary statements, suggesting a favorable safety profile when handled correctly. Regulatory listings include CAS number 2120-70-9 and ECHA registration under EC number 218-329-5. Users should consult detailed safety data and comply with local regulations during formulation and handling.

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Other Information

General Material Information

Preferred name phenoxyacetaldehyde 50% in benzyl alcohol
Trivial Name Phenoxyacetaldehyde
Short Description cortex aldehyde 50 (IFF)
Formula C8 H8 O2
CAS Number 2120-70-9
ECHA Number 218-329-5
FDA UNII Search
Nikkaji Number J33.410C
Beilstein Number 0970857
MDL MFCD00134414
NMR Predictor External link
Synonyms
  • acetaldehyde, 2-phenoxy-
  • acetaldehyde, phenoxy-
  • aldehyde cortex
  • aldehyde cortex 50 (IFF)
  • cortex aldehyde 50 (IFF)
  • cortex aldehyde 50% benzyl alcohol (IFF)
  • phenoxy acetaldehyde 50% in benzyl alcohol
  • phenoxy-acetaldehyde
  • 2-( phenoxy)acetaldehyde 50% in benzyl alcohol
  • phenoxyacetaldehyde
  • 2-phenoxyacetaldehyde 50% in benzyl alcohol
  • 2-phenoxyacetaldehyde
  • 2-Phenoxyethanal
  • NSC 49355

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 136.15016174316
Specific gravity @ 25 °C
Pounds per Gallon 9.32 to 9.486
Specific gravity @ 20 °C
Pounds per Gallon 9.339 to 9.505
Refractive Index 1.545 to 1.565 @ 20 °C
Vapor Pressure 0.113 mmHg @ 25 °C
Flash Point TCC Value 85 °C TCC
logP (o/w) 1.134 est
Solubility
alcohol Yes
water, 1.048e+004 mg/L @ 25 °C (est) Yes
water No

Organoleptic Properties

Odor Type: Green
fresh, green, cortex, leafy, hyacinth, ozone, leathery
Odor strength medium , recommend smelling in a 10.00 % solution or less
Substantivity 188 hour(s) at 100.00 %
Luebke, William tgsc, (1990) At 10.00 % in dipropylene glycol. fresh green cortex leafy hyacinth ozone leather
Flavor Type: Green
green, cortex, leafy, melon rind, watery, phenolic
Luebke, William tgsc, (1990) Green cortex leafy melon rind watery phenolic

Potential Uses

Applications
Odor purposes Cortex , Fresh outdoors , Hyacinth , Leather , Lily of the valley
Other purposes Freshener , Grass , Leaf
Cosmetic purposes Perfuming agents

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:
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 phenoxyacetaldehyde 50% in benzyl alcohol usage levels up to:
2.0000 % in the fragrance concentrate.
Recommendation for phenoxyacetaldehyde 50% in benzyl alcohol 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):2120-70-9
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :75033
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
2-phenoxyacetaldehyde
Chemidplus:0002120709
RTECS:AB2990000 for cas# 2120-70-9