Methyl acetopyruvate - CAS 20577-61-1
Catalog: |
BB016077 |
Product Name: |
Methyl acetopyruvate |
CAS: |
20577-61-1 |
Synonyms: |
methyl 2,4-dioxopentanoate |
IUPAC Name: | methyl 2,4-dioxopentanoate |
Description: | Methyl acetopyruvate (CAS# 20577-61-1) is a useful research chemical. |
Molecular Weight: | 144.13 |
Molecular Formula: | C6H8O4 |
Canonical SMILES: | CC(=O)CC(=O)C(=O)OC |
InChI: | InChI=1S/C6H8O4/c1-4(7)3-5(8)6(9)10-2/h3H2,1-2H3 |
InChI Key: | OMHOEQINEXASKE-UHFFFAOYSA-N |
Boiling Point: | 195.1 °C at 760 mmHg |
Density: | 1.15 g/cm3 |
MDL: | MFCD00043638 |
LogP: | -0.29240 |
GHS Hazard Statement: | H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P280, P305+P351+P338, and P337+P313 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2020243584-A1 | Crystalline polymorphs of a 1-thiazol-2-yl-pyrazole-5-carboxylic acid derivative | 20190531 |
EP-3896062-A1 | Isoindoline compound, and preparation method, pharmaceutical composition, and application of isoindoline compound | 20181206 |
US-2020131172-A1 | Dynamin-1-like protein inhibitors | 20170426 |
WO-2018200674-A1 | Dynamin-1-like protein inhibitors | 20170426 |
EP-3548024-A2 | Methods of using substituted pyrazole and pyrazole compounds and for treatment of hyperproliferative diseases | 20161130 |
PMID | Publication Date | Title | Journal |
21878618 | 20111021 | Identification of human fumarylacetoacetate hydrolase domain-containing protein 1 (FAHD1) as a novel mitochondrial acylpyruvase | The Journal of biological chemistry |
Complexity: | 171 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 144.04225873 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 144.04225873 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 60.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.1 |
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