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propyl salicylate

Propyl salicylate is an ester compound known for its floral and fruity odor notes, widely used as a fragrance agent in various applications.
Chemical Structure

General Material Description

Propyl salicylate is a chemical ester with the molecular formula C10H12O3, functionally described as 2-hydroxybenzoic acid propyl ester. It appears as a clear liquid with a characteristic floral odor having additional fruity nuances reminiscent of vine, clover, and plum. This compound is known by several synonyms including propyl 2-hydroxybenzoate, salicylic acid propyl ester, and n-propyl salicylate. It is classified within fragrance agents and linked in chemical databases such as PubChem (CID 69092). Procured typically through chemical synthesis from salicylic acid derivatives, propyl salicylate serves as a valuable component in perfumery due to its distinct olfactory profile.

Occurrence, Applicability & Potential Uses

Propyl salicylate occurs primarily as a synthesized ester and does not naturally accumulate in significant biological systems. It is extensively employed in fragrance formulations to impart floral, clover, magnolia, orchid, plum, and wallflower notes. Usage also extends to enhancing vine-like qualities in scent blends. The application of propyl salicylate aligns with recommendations established in the IFRA (Global) Code of Practice, which governs fragrance ingredient use standards internationally. This ensures controlled use levels that balance efficacy with safety in consumer products.

Physico-Chemical Properties Summary

Propyl salicylate exhibits physicochemical characteristics that influence its integration into formulations. It has a melting point range of 96 to 97°C and a boiling point near 239 to 240°C at atmospheric pressure (760 mm Hg). The compound’s specific gravity at 20°C ranges from 1.097 to 1.101, and its refractive index varies between 1.514 and 1.517 under the same conditions. A partition coefficient (log P) of approximately 3.8 indicates moderate lipophilicity, affecting its solubility and permeability in formulations. Its vapor pressure is low at 0.027 mmHg at 25°C, suggesting limited volatility. Propyl salicylate is soluble in alcohol and has an estimated water solubility of 118.8 mg/L at 25°C, yet it is generally considered insoluble in pure water. These properties contribute to its suitability for stable fragrance compositions.

FAQ

What is propyl salicylate and what are its primary characteristics?
Propyl salicylate is an ester compound with the chemical name 2-hydroxybenzoic acid propyl ester. It is commonly used as a fragrance agent due to its floral and fruity odor notes such as vine, clover, and plum. The compound appears as a clear liquid with a molecular formula of C10H12O3. It is known by several synonyms including propyl 2-hydroxybenzoate and salicylic acid propyl ester. Its pleasant aromatic profile makes it valuable in perfumery and scented product formulations.
How is propyl salicylate used and where is it typically found?
Propyl salicylate is predominantly used in the fragrance industry to add floral, clover, magnolia, orchid, plum, and wallflower notes to perfumes and scented products. It is usually synthetically produced rather than sourced from natural origins. The compound's solubility in alcohol and its moderate volatility allow for versatile formulation possibilities. Its application levels are guided by IFRA (Global) standards to ensure safe and effective use in consumer fragrances.
What safety regulations and sourcing information apply to propyl salicylate?
According to regulatory assessments, propyl salicylate is classified as an irritant (Xi) with noted risks of skin and eye irritation, requiring appropriate handling precautions. Regulatory recommendations such as the IFRA Code of Practice (Global) set maximum usage levels, typically up to 2.0000% in fragrance concentrates. Safety data sheets provide detailed guidance on safe handling, protective measures, and disposal. The compound is registered under identifiers including CAS 607-90-9 and REACH (EC Number 210-145-3). Sourcing is predominantly through chemical synthesis under controlled manufacturing conditions to comply with safety and quality standards.

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
CHEMBL:View
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2918.23.5000
ChemSpider:View

General Material Information

Preferred name propyl salicylate
Trivial Name Propyl salicylate
Short Description 2-hydroxybenzoic acid propyl ester
Formula C10 H12 O3
CAS Number 607-90-9
ECHA Number 210-145-3
FDA UNII 8CP40IDZ6D
Nikkaji Number J47.837G
MDL MFCD00045763
NMR Predictor External link
Synonyms
  • 2-hydroxybenzoic acid propyl ester
  • propyl 2-hydroxybenzoate
  • propyl o-hydroxybenzoate
  • propyl ortho-hydroxybenzoate
  • salicylic acid propyl ester
  • Benzoic acid, 2-hydroxy-, propyl ester
  • Salicylic acid, propyl ester
  • n-Propyl salicylate
  • NSC 8221

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 180.20324707031
Specific gravity @ 20 °C
Pounds per Gallon 9.139 to 9.172
Refractive Index 1.514 to 1.517 @ 20 °C
Melting Point 96 to 97°C @ 760 mm Hg
Boiling Point 239 to 240°C @ 760 mm Hg
Vapor Pressure 0.027 mmHg @ 25 °C
Flash Point TCC Value 100.56 °C TCC
logP (o/w) 3.8
Solubility
alcohol Yes
water, 118.8 mg/L @ 25 °C (est) Yes
water No

Organoleptic Properties

Odor Type: Floral
foliage, clover, fruity, plum
General comment At 100.00 %. vine clover fruity plum

Potential Uses

Applications
Odor purposes Clover , Magnolia , Orchid , Plum , Wallflower
Other purposes Vine

Safety Information

Safety information

Preferred SDS: View
European information :
Most important hazard(s):
Xi - Irritant
R 36/38 - Irritating to skin and eyes.
S 02 - Keep out of the reach of children.
S 24/25 - Avoid contact with skin and eyes.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36 - Wear suitable protective clothing.
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 propyl salicylate usage levels up to:
2.0000 % in the fragrance concentrate.
Recommendation for propyl salicylate 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):607-90-9
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :69092
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
propyl 2-hydroxybenzoate
Chemidplus:0000607909