6044-68-4
Product Name:
Acrolein dimethyl acetal
Formula:
C5H10O2
Synonyms:
3,3-Dimethoxy-1-propene
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CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Colorless liquid with an unpleasant odor; [Alfa Aesar MSDS] |
|---|---|
| Vapor Pressure | 85.0 [mmHg] |
| Kovats Retention Index | 668 |
| Chemical Classes | Other Classes -> Ethers, Other |
SAFETY INFORMATION
| Signal word | Danger |
|---|---|
| Pictogram(s) |
 Flame Flammables GHS02 |
| GHS Hazard Statements |
H225:Flammable liquids |
| Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. |
COMPUTED DESCRIPTORS
| Molecular Weight | 102.13 g/mol |
|---|---|
| XLogP3 | 0.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 102.068079557 g/mol |
| Monoisotopic Mass | 102.068079557 g/mol |
| Topological Polar Surface Area | 18.5 Ų |
| Heavy Atom Count | 7 |
| Formal Charge | 0 |
| Complexity | 48 |
| 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 |