Ethyl 2-Methyl-4-oxo-4,5-dihydrofuran-3-carboxylate - CAS 3511-34-0
Catalog: |
BB022476 |
Product Name: |
Ethyl 2-Methyl-4-oxo-4,5-dihydrofuran-3-carboxylate |
CAS: |
3511-34-0 |
Synonyms: |
2-methyl-4-oxo-3-furancarboxylic acid ethyl ester; ethyl 2-methyl-4-oxofuran-3-carboxylate |
IUPAC Name: | ethyl 2-methyl-4-oxofuran-3-carboxylate |
Description: | Ethyl 2-Methyl-4-oxo-4,5-dihydrofuran-3-carboxylate (CAS# 3511-34-0) is a useful research chemical. |
Molecular Weight: | 170.16 |
Molecular Formula: | C8H10O4 |
Canonical SMILES: | CCOC(=O)C1=C(OCC1=O)C |
InChI: | InChI=1S/C8H10O4/c1-3-11-8(10)7-5(2)12-4-6(7)9/h3-4H2,1-2H3 |
InChI Key: | DLCRRDMHCZRVPB-UHFFFAOYSA-N |
LogP: | 0.42280 |
Publication Number | Title | Priority Date |
WO-2021181122-A1 | Gpr52 modulator compounds | 20200313 |
WO-2021055326-A1 | Azole-fused pyridazin-3(2h)-one derivatives | 20190916 |
EP-3350187-A1 | Substituted isoxazolopyridazinones and isothiazolopyridazinones and methods of use | 20150915 |
US-10556914-B2 | Substituted isoxazolopyridazinones and isothiazolopyridazinones and methods of use | 20150915 |
US-2017073353-A1 | Substituted isoxazolopyridazinones and isothiazolopyridazinones and methods of use | 20150915 |
Complexity: | 252 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 170.0579088 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 170.0579088 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 52.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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