5232-99-5
Product Name:
Ethyl 2-cyano-3,3-diphenylacrylate
Formula:
C18H15NO2
Synonyms:
2-Cyano-3,3-diphenyl-2-propenoic acid ethyl ester;Ethyl α-cyano-β,β-diphenylacrylate;Ethyl 2-cyano-3,3-diphenyl-2-propenoate
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Dry Powder; Other Solid |
|---|---|
| Color/Form | Solid |
| Melting Point | 95-97 °C |
| Vapor Pressure | 0.00000036 [mmHg] |
| LogP | log Kow = 4.01 /Estimated/ |
| Henry's Law Constant | Henry's Law constant = 5.5X10-10 atm cu m/mol @ 25 °C /Estimated/ |
| Other Experimental Properties | Hydroxyl radical reaction rate constant = 1.1X10-11 cu cm/molecule-sec @ 25 °C /Estimated/ |
| Chemical Classes | Other Uses -> Sunscreens |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Exclamation Mark Irritant GHS07  Environment GHS09 |
| GHS Hazard Statements |
H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation H410:Hazardous to the aquatic environment, long-term hazard |
| Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P271:Use only outdoors or in a well-ventilated area. P273:Avoid release to the environment. P302+P352:IF ON SKIN: wash with plenty of soap and water. 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 | 277.3 g/mol |
|---|---|
| XLogP3 | 4.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 5 |
| Exact Mass | 277.110278721 g/mol |
| Monoisotopic Mass | 277.110278721 g/mol |
| Topological Polar Surface Area | 50.1 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 411 |
| 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 |