609-08-5
Product Name:
Diethyl methylmalonate
Formula:
C8H14O4
Synonyms:
Methylmalonic acid diethyl ester
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Clear colorless liquid; [Acros Organics MSDS] |
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Kovats Retention Index | 1073 |
Chemical Classes | Other Classes -> Esters, Other |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H227:Flammable liquids |
Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. 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 | 174.19 g/mol |
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XLogP3 | 1.4 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 6 |
Exact Mass | 174.08920892 g/mol |
Monoisotopic Mass | 174.08920892 g/mol |
Topological Polar Surface Area | 52.6 Ų |
Heavy Atom Count | 12 |
Formal Charge | 0 |
Complexity | 146 |
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 |