butyl salicylate
salicylic acid, butyl ester
Identification
| Name | butyl salicylate |
| IUPAC | butyl 2-hydroxybenzoate |
| CAS Number | 2052-14-4 |
| EINECS | 218-142-9 |
| FDA UNII | QPR9LM8VZO |
| Molecular Formula | C11 H14 O3 |
| Molecular Weight | 194.23018000 |
| MDL Number | MFCD00020038 |
| Nikkaji Number | J36.458D |
| Beilstein | 2208904 |
| CoE Number | 614 |
| XlogP3 | 4.60 (est) |
Regulatory
| JECFA Food Flavoring | 901 butyl salicylate |
| DG SANTE Food Flavourings | 09.763 butyl salicylate |
| FEMA Number | 3650 |
| FDA | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF) | 2052-14-4 ; BUTYL SALICYLATE |
Physical Properties
| Appearance | colorless clear liquid (est) |
| Assay | 98.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Specific Gravity | 1.07000 to 1.08000 @ 25.00 °C. |
| Pounds per Gallon - (est). | 8.903 to 8.987 |
| Refractive Index | 1.50800 to 1.52000 @ 20.00 °C. |
| Melting Point | -5.90 °C. @ 760.00 mm Hg |
| Boiling Point | 271.00 °C. @ 760.00 mm Hg |
| Acid Value | 1.00 max. KOH/g |
| Vapor Pressure | 0.004000 mmHg @ 25.00 °C. (est) |
| Flash Point | > 212.00 °F. TCC ( > 100.00 °C. ) |
| logP (o/w) | 4.630 |
| Soluble in | alcohol |
| Insoluble in | water |
| Stability | non-discoloring in most media |
| Similar Items | note |
Cosmetic Information
| CosIng | cosmetic data |
| Cosmetic Uses | perfuming agents |
Organoleptic Properties
| Odor Description | at 10.00 % in dipropylene glycol. |
Safety Information
| Preferred SDS | View |
| European information | Most important hazard(s): |
| Oral/Parenteral Toxicity | oral-rat LD50 1836 mg/kg |
| Dermal Toxicity | Not determined |
| Inhalation Toxicity | Not determined |
GHS Classification
['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']
Safety in Use
| Category | flavor and fragrance agents |
| RIFM Fragrance Material Safety Assessment | Search |
| limits in the finished product for - "leave on the skin contact" | 0.2000 % Recommendation. |
| Recommendation for butyl salicylate usage levels up to | 0.1000 % in the fragrance concentrate. |
| Maximised Survey-derived Daily Intakes (MSDI-EU) | 0.012 (μg/capita/day) |
| Maximised Survey-derived Daily Intakes (MSDI-USA) | 0.0007 (μg/capita/day) |
| baked goods | - |
| beverages(nonalcoholic) | - |
| beverages(alcoholic) | - |
| breakfast cereal | - |
| cheese | - |
| chewing gum | - |
| condiments / relishes | - |
| confectionery froastings | - |
| egg products | - |
| fats / oils | - |
| fish products | - |
| frozen dairy | - |
| fruit ices | - |
| gelatins / puddings | - |
| granulated sugar | - |
| gravies | - |
| hard candy | - |
| imitation dairy | - |
| instant coffee / tea | - |
| jams / jellies | - |
| meat products | - |
| milk products | - |
| nut products | - |
| other grains | - |
| poultry | - |
| processed fruits | - |
| processed vegetables | - |
| reconstituted vegetables | - |
| seasonings / flavors | - |
| snack foods | - |
| soft candy | - |
| soups | - |
| sugar substitutes | - |
| sweet sauces | - |
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Potential Uses
Natural Occurrence
Synonyms
benzoic acid, hydroxy-, butyl ester
butyl (2-hydroxyphenyl) formate
butyl (2-hydroxyphenyl)formate
butyl 2-hydroxybenzoate
butyl 2-hydroxyphenyl formate
butyl o-hydroxybenzoate
N-
butyl o-hydroxybenzoate
N-
butyl ortho-hydroxybenzoate
N-
butyl salicylate
butylsalicylate
2-
hydroxybenzoic acid butyl ester
nefolia
salicylic acid butyl ester
salicylic acid, butyl ester
PubMed:
Ultrasound-assisted third-liquid phase-transfer catalyzed esterification of sodium salicylate in a continuous two-phase-flow reactor.
PubMed:
DFT and ab initio study of structure of dyes derived from 2-hydroxy and 2,4-dihydroxy benzoic acids.
PubMed:
Differentiated in vivo skin penetration of salicylic compounds in hairless rats measured by cutaneous microdialysis.
PubMed:
Development of an in vivo animal model for skin penetration in hairless rats assessed by mass balance.
PubMed:
In vivo skin penetration of salicylic compounds in hairless rats.
PubMed:
The effect of topically applied salicylic compounds on serotonin-induced scratching behaviour in hairless rats.