Ethyl (E)-3-Ethoxyacrylate - CAS 5941-55-9
Catalog: |
BB030375 |
Product Name: |
Ethyl (E)-3-Ethoxyacrylate |
CAS: |
5941-55-9 |
Synonyms: |
(E)-3-ethoxy-2-propenoic acid ethyl ester; ethyl (E)-3-ethoxyprop-2-enoate |
IUPAC Name: | ethyl (E)-3-ethoxyprop-2-enoate |
Description: | Ethyl trans-3-Ethoxyacrylate can be used in the preparation of N-[3-(3-Cyanopyrazolo[1,5-a]pyrimidin-5-yl)phenyl]-N-ethylacetamide, a principal impurity of Zaleplon (Z145000). |
Molecular Weight: | 144.17 |
Molecular Formula: | C7H12O3 |
Canonical SMILES: | CCOC=CC(=O)OCC |
InChI: | InChI=1S/C7H12O3/c1-3-9-6-5-7(8)10-4-2/h5-6H,3-4H2,1-2H3/b6-5+ |
InChI Key: | ITQFPVUDTFABDH-AATRIKPKSA-N |
Boiling Point: | 196 ℃ |
Density: | 1 g/cm3 |
LogP: | 1.09970 |
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 |
CN-113477606-A | Method for removing paint of ship structure | 20210629 |
CN-112892436-A | Full continuous flow production process of 1-alkyl-5-hydroxypyrazole | 20201230 |
WO-2021207343-A1 | Malt1 inhibitors and uses thereof | 20200408 |
WO-2021165834-A1 | 5-(3-(ethylsulfonyl)pyridin-2-yl)-pyrazolo[1,5-a]pyrimidine derivatives and related compounds as pesticide and insecticide agents for crop protection | 20200218 |
WO-2021155320-A1 | Compounds and uses thereof | 20200129 |
PMID | Publication Date | Title | Journal |
15497746 | 20040901 | [Bisbenzothieno[3,2-b: 2',3'-e]pyridines] | Die Pharmazie |
Complexity: | 118 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
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: | 35.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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