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 |
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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 |
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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 |
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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 |