28069-74-1
Product Name:
ACETALDEHYDE ETHYL CIS-3-HEXENYL ACETAL
Formula:
C10H20O2
Synonyms:
Acetaldehyde ethyl cis-3-hexenyl acetal;Ethyl cis-3-hexenyl acetal acetaldehyde;Leaf acetal
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | colourless mobile liquid with a powerful, green, herbaceous odour |
|---|---|
| Solubility | insoluble in water; soluble in organic solvents, oils |
| Density | 0.846-0.856 |
| Refractive Index | 1.430-1.435 |
| Kovats Retention Index | 1094 1095 |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Flame Flammables GHS02 |
| GHS Hazard Statements |
H226:Flammable liquids H227:Flammable liquids H402:Hazardous to the aquatic environment, acute hazard |
| Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P273:Avoid release to the environment. P280:Wear protective gloves/protective clothing/eye protection/face protection. P370+P378:In case of fire: Use … for extinction. P403+P235:Store in a well-ventilated place. Keep cool. P501:Dispose of contents/container to..… |
COMPUTED DESCRIPTORS
| Molecular Weight | 172.26 g/mol |
|---|---|
| XLogP3 | 2.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 7 |
| Exact Mass | 172.146329876 g/mol |
| Monoisotopic Mass | 172.146329876 g/mol |
| Topological Polar Surface Area | 18.5 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 110 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |