78086-72-3
Product Name:
Methyl (4R,5S)-2,2,5-trimethyl-1,3-dioxolane-4-carboxylate
Formula:
C8H14O4
Synonyms:
4-Deoxy-2,3-O-isopropylidene-L -threonic acid methyl ester;Methyl (2R,3S)-2,3-O-isopropylidene-2,3-dihydroxybutyrate;Methyl 4-deoxy-2,3-O-isopropylidene-L -threonate
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SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Flame Flammables GHS02 |
| GHS Hazard Statements |
H226:Flammable liquids |
| Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P233:Keep container tightly closed. P240:Ground/bond container and receiving equipment. P241:Use explosion-proof electrical/ventilating/lighting/…/equipment. P242:Use only non-sparking tools. P243:Take precautionary measures against static discharge. |
COMPUTED DESCRIPTORS
| Molecular Weight | 174.19 g/mol |
|---|---|
| XLogP3 | 0.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 174.08920892 g/mol |
| Monoisotopic Mass | 174.08920892 g/mol |
| Topological Polar Surface Area | 44.8 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 188 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |