Ethylmalonic Acid

Product Information

Molecular Formula:
C5H8O4
Molecular Weight:
132.11
Description
Ethylmalonic Acid (CAS# 601-75-2) is used as a diagnostic agent used in the diagnosis of Ethylmalonic encephalopathy which is a rare autosomal recessive inborn error of metabolism.
Synonyms
2-ethylpropanedioic acid; 2-ethylpropanedioic acid
IUPAC Name
2-ethylpropanedioic acid
Canonical SMILES
CCC(C(=O)O)C(=O)O
InChI
InChI=1S/C5H8O4/c1-2-3(4(6)7)5(8)9/h3H,2H2,1H3,(H,6,7)(H,8,9)
InChI Key
UKFXDFUAPNAMPJ-UHFFFAOYSA-N
Boiling Point
322.2 °C at 760 mmHg
Melting Point
112-114 °C (lit.)
Flash Point
Not applicable
Purity
97 %
Density
1.311 g/cm3
Solubility
712.0 mg/mL
Appearance
Solid
LogP
0.18180

Safety Information

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

Computed Properties

XLogP3
0.4
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
3
Exact Mass
132.04225873 g/mol
Monoisotopic Mass
132.04225873 g/mol
Topological Polar Surface Area
74.6Ų
Heavy Atom Count
9
Formal Charge
0
Complexity
115
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

Patents

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CN-113967287-A Antibacterial low-toxicity tooth/bone repair active material and preparation method thereof 2021-11-26
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CN-113372691-A Resin composition, reinforcing liquid, reinforcing layer, and optical protective film 2021-06-23
CN-113278021-A Preparation method of 1, 7-diazaspiro [3.5] nonane-7-tert-butyl formate and oxalate thereof 2021-05-29
CN-113289049-A Preparation method of acrylic foam material absorption core 2021-05-28
CN-113289049-B Preparation method of acrylic foam material absorption core 2021-05-28
CN-114062570-A Method for evaluating quality of pinellia ternate and sparrow lawn pinellia ternate based on organic acid 2021-04-27
CN-113101937-A Doped mixed-valence copper catalyst and preparation method and application thereof 2021-04-25
CN-113024374-A Kit and method for simultaneously extracting organic acid and amino acid 2021-03-12

Literatures

PMID Publication Date Title Journal
22821849 2012-10-01 Cannabinoid receptor antagonist-induced striated muscle toxicity and ethylmalonic-adipic aciduria in beagle dogs Toxicological sciences : an official journal of the Society of Toxicology
22786886 2012-09-01 Arabidopsis ETHE1 encodes a sulfur dioxygenase that is essential for embryo and endosperm development Plant physiology
22424739 2012-05-01 Biochemical, molecular, and clinical characteristics of children with short chain acyl-CoA dehydrogenase deficiency detected by newborn screening in California Molecular genetics and metabolism
22133302 2012-01-01 Ethylmalonic acid impairs brain mitochondrial succinate and malate transport Molecular genetics and metabolism
22016388 2011-12-16 Ethylmalonyl-CoA decarboxylase, a new enzyme involved in metabolite proofreading The Journal of biological chemistry
21985395 2011-11-07 Synthesis, structural analysis, and magnetic properties of ethylmalonate-manganese(II) complexes Inorganic chemistry
21843962 2011-11-01 Decreased oxidative phosphorylation and PGAM deficiency in horses suffering from atypical myopathy associated with acquired MADD Molecular genetics and metabolism
21689452 2011-06-20 Efficacy and outcome of expanded newborn screening for metabolic diseases--report of 10 years from South-West Germany Orphanet journal of rare diseases
20440652 2011-04-01 Biochemical diagnosis of mitochondrial disorders Journal of inherited metabolic disease
20528888 2011-04-01 Ethylmalonic encephalopathy: application of improved biochemical and molecular diagnostic approaches Clinical genetics
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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