Methylmalonic acid - CAS 516-05-2
Catalog: |
BB027511 |
Product Name: |
Methylmalonic acid |
CAS: |
516-05-2 |
Synonyms: |
2-methylpropanedioic acid |
IUPAC Name: | 2-methylpropanedioic acid |
Description: | Methylmalonate, a dicarboxylic acid that can be derived from methylmalonyl-coenzyme A (methylmalonyl-CoA), binds with coenzyme A to form methylmalonyl-CoA. It is a reversible succinate dehydrogenase inhibitor used to generate Huntington's disease models and induces apoptotic cell death in striatal neurons. |
Molecular Weight: | 118.09 |
Molecular Formula: | C4H6O4 |
Canonical SMILES: | CC(C(=O)O)C(=O)O |
InChI: | InChI=1S/C4H6O4/c1-2(3(5)6)4(7)8/h2H,1H3,(H,5,6)(H,7,8) |
InChI Key: | ZIYVHBGGAOATLY-UHFFFAOYSA-N |
Boiling Point: | 334.4 ℃ at 760 mmHg |
Melting Point: | 135 °C |
Purity: | > 98 % |
Density: | 1.45 g/cm3 |
Solubility: | 679.0 mg/mL |
Appearance: | Solid |
Storage: | Store in a cool and dry place (or refer to the Certificate of Analysis). |
MDL: | MFCD00002656 |
LogP: | -0.20830 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2016168408-A1 | Silver ink | 20140805 |
EP-2959981-A1 | A coating system | 20140626 |
WO-2015197552-A1 | A coating system | 20140626 |
EP-2960319-A2 | Hydrocarbyl soluble quaternary ammonium carboxylates and fuel compositions containing them | 20140625 |
WO-2015192942-A1 | Fullerene derivatives | 20140617 |
PMID | Publication Date | Title | Journal |
28160606 | 20170501 | Identification and pharmacological characterization of succinate receptor agonists | British journal of pharmacology |
28223158 | 20170301 | Aminoguanidine alleviated MMA-induced impairment of cognitive ability in rats by downregulating oxidative stress and inflammatory reaction | Neurotoxicology |
24923549 | 20140902 | Trichloroethylene and trichloroethanol-induced formic aciduria and renal injury in male F-344 rats following 12 weeks exposure | Toxicology |
23026888 | 20121101 | High resolution melting analysis of the MMAA gene in patients with cblA and in those with undiagnosed methylmalonic aciduria | Molecular genetics and metabolism |
23071203 | 20121101 | Sani-cloth wipe mimics rare enzyme deficiency malonic aciduria on newborn screen | Pediatrics |
Complexity: | 103 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 118.02660867 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 118.02660867 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 74.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.1 |
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