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ChemicalBook--->CAS DataBase List--->87-19-4

87-19-4

87-19-4 Structure

87-19-4 Structure
IdentificationMore
[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 PropertiesBack 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 DataBack 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
Raw materials And Preparation ProductsBack Directory
[Raw materials]

2-Methyl-1-propanol-->Salicylic acid
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

2-Methylpropyl o-hydroxybenzoate(87-19-4).msds
Hazard InformationBack 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
Spectrum DetailBack Directory
[Spectrum Detail]

Isobutyl salicylate(87-19-4)MS
Isobutyl salicylate(87-19-4)1HNMR
Isobutyl salicylate(87-19-4)13CNMR
Isobutyl salicylate(87-19-4)IR1
Isobutyl salicylate(87-19-4)IR2
Isobutyl salicylate(87-19-4)Raman
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

87-19-4(sigmaaldrich)
[TCI AMERICA]

Isobutyl Salicylate,>99.0%(GC)(87-19-4)
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