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28069-74-1

28069-74-1 structural image
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
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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