Ethyl propionylacetate - CAS 4949-44-4
Catalog: |
BB026715 |
Product Name: |
Ethyl propionylacetate |
CAS: |
4949-44-4 |
Synonyms: |
ethyl 3-oxopentanoate |
IUPAC Name: | ethyl 3-oxopentanoate |
Description: | An intermediate of Rosuvastatin. |
Molecular Weight: | 144.17 |
Molecular Formula: | C7H12O3 |
Canonical SMILES: | CCC(=O)CC(=O)OCC |
InChI: | InChI=1S/C7H12O3/c1-3-6(8)5-7(9)10-4-2/h3-5H2,1-2H3 |
InChI Key: | UDRCONFHWYGWFI-UHFFFAOYSA-N |
Boiling Point: | 83-84 °C (12 mmHg) |
Density: | 1.012 g/cm3 |
MDL: | MFCD00009317 |
LogP: | 0.91870 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021119081-A1 | Hepatitis b capsid assembly modulators | 20191210 |
WO-2021110858-A1 | Enzyme mediated process | 20191204 |
US-2021188874-A1 | Heterocyclic compounds as delta-5 desaturase inhibitors and methods of use | 20191125 |
WO-2021092892-A1 | Application of quinoline or quinazoline compound in preparation of antitumor drugs | 20191115 |
WO-2021075558-A1 | Adhesive, adhesive sheet and optical member | 20191018 |
PMID | Publication Date | Title | Journal |
22072936 | 20110101 | Anti-UVC irradiation and metal chelation properties of 6-benzoyl-5,7-dihydroxy-4-phenyl-chromen-2-one: an implications for anti-cataract agent | International journal of molecular sciences |
Complexity: | 129 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 144.078644241 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 144.078644241 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 43.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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