Identification | More | [Name]
Isobutyl salicylate | [CAS]
87-19-4 | [Synonyms]
2-HYDROXYBENZOIC ACID ISOBUTYL ESTER 2-methylpropyl o-hydroxybenzoate FEMA 2213 ISOBUTYL 2-HYDROXYBENZOATE ISOBUTYL O-HYDROXYBENZOATE ISOBUTYL SALICYLATE SALICYLIC ACID ISOBUTYL ESTER 2-hydroxy-benzoicaci2-methylpropylester 2-Isobutoxycarbonylphenol 2-methylpropyl salicylate Benzoicacid,2-hydroxy-,2-methylpropylester Orchindone Isobuty Salicylate ISOBUTYL SALICYLATE 98+% FCC ISOBUTYL SALICYLATE FCC (1,1-Diemethylethyl)calisinlate 2-Methylpropyl 2-hydroxybenzoate 2-Hydroxybenzoic acid 2-methylpropyl ester o-Hydroxybenzoic acid isobutyl ester Salicylic acid isobutyl | [EINECS(EC#)]
201-729-9 | [Molecular Formula]
C11H14O3 | [MDL Number]
MFCD00020035 | [Molecular Weight]
194.23 | [MOL File]
87-19-4.mol |
Chemical Properties | Back Directory | [Appearance]
Colorless liquid; may have slightly yellowish tinge.Soluble in alcohol and mineral oil, insoluble in water
and glycerol. Combustible. | [Melting point ]
5.9°C | [Boiling point ]
267 °C(lit.) | [density ]
1.064 g/mL at 25 °C(lit.)
| [vapor pressure ]
5Pa at 20℃ | [FEMA ]
2213 | [refractive index ]
n20/D 1.509(lit.)
| [Fp ]
230 °F
| [form ]
clear liquid | [pka]
8.11±0.30(Predicted) | [color ]
Colorless to Almost colorless | [Odor]
at 10.00 % in dipropylene glycol. clover herbal orchid floral | [Odor Type]
floral | [Water Solubility ]
19.5mg/L at 20℃ | [JECFA Number]
902 | [LogP]
4.09 at 21.9℃ | [Uses]
Perfumery, flavoring. | [CAS DataBase Reference]
87-19-4(CAS DataBase Reference) | [NIST Chemistry Reference]
Benzoic acid, 2-hydroxy-, 2-methylpropyl ester(87-19-4) | [EPA Substance Registry System]
87-19-4(EPA Substance) |
Safety Data | Back Directory | [Hazard Codes ]
Xn | [Risk Statements ]
R22:Harmful if swallowed. | [Safety Statements ]
S36:Wear suitable protective clothing . | [WGK Germany ]
3
| [RTECS ]
VO4320000
| [HS Code ]
2918.23.5000 | [Toxicity]
The acute oral LD50 value in rats was reported as 1.56 g/kg (1.32-1.80 g/kg) and the acute dermal LD50 value in rabbits as > 5 g/kg |
Hazard Information | Back Directory | [Description]
Isobutyl salicylate has an orchid, wintergreen-like odor similar to
amyl salicylate and a bitter taste. May be synthesized by esterification of isobutyl alcohol and salicylic acid. | [Chemical Properties]
Colorless liquid; may have slightly yellowish tinge.Soluble in alcohol and mineral oil, insoluble in water
and glycerol. Combustible. | [Chemical Properties]
Isobutyl salicylate has a somewhat harsh, floral, herbaceous odor similar to amyl salicylate and a bitter taste. | [Occurrence]
Has apparently not been reported to occur in nature | [Definition]
ChEBI: Isobutyl salicylate is a member of phenols and a benzoate ester. It is functionally related to a salicylic acid. | [Preparation]
By esterification of isobutyl alcohol and salicylic acid. | [Taste threshold values]
Taste characteristics at 3 ppm: sweet, cooling, spicy with fruity nuances | [Flammability and Explosibility]
Notclassified |
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