3572-06-3
Product Name:
4-(4-Acetoxyphenyl)-2-butanone
Formula:
C12H14O3
Synonyms:
4-(3-Oxobutyl)phenyl acetate;4-(4-Acetoxyphenyl)-2-butanone;Cue-lure;Q-lure;raspberry ketone acetate
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Yellow liquid, sweet raspberry fruity odour |
|---|---|
| Boiling Point | 123.00 to 124.00 °C. @ 0.20 mm Hg |
| Solubility | insoluble in water; soluble in fat |
| Density | 1.096-1.100 |
| Refractive Index | 1.506-1.512 |
SAFETY INFORMATION
| Signal word | Danger |
|---|---|
| Pictogram(s) |
 Exclamation Mark Irritant GHS07  Health Hazard GHS08  Environment GHS09 |
| GHS Hazard Statements |
H402:Hazardous to the aquatic environment, acute hazard |
| Precautionary Statement Codes |
P273:Avoid release to the environment. P501:Dispose of contents/container to..… |
COMPUTED DESCRIPTORS
| Molecular Weight | 206.24 g/mol |
|---|---|
| XLogP3 | 1.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 5 |
| Exact Mass | 206.094294304 g/mol |
| Monoisotopic Mass | 206.094294304 g/mol |
| Topological Polar Surface Area | 43.4 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 227 |
| 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
Cuelure is a benzoate ester and a member of phenols.