87-22-9
Product Name:
PHENETHYL SALICYLATE
Formula:
C15H14O3
Synonyms:
Benzyl carbinyl salicylate
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CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Solid |
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Boiling Point | 370.00 °C. @ 760.00 mm Hg |
Melting Point | 44 °C |
Solubility | insoluble in water, glycerol, glycols; soluble in organic solvents, oils |
Kovats Retention Index | 1934 1966 1930 |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
COMPUTED DESCRIPTORS
Molecular Weight | 242.27 g/mol |
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XLogP3 | 4.5 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 5 |
Exact Mass | 242.094294304 g/mol |
Monoisotopic Mass | 242.094294304 g/mol |
Topological Polar Surface Area | 46.5 Ų |
Heavy Atom Count | 18 |
Formal Charge | 0 |
Complexity | 259 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Phenethyl salicylate is a member of phenols and a benzoate ester. It is functionally related to a salicylic acid.