(2E)-Ethyl 3-Ethoxy-2-methylprop-2-enoate - CAS 1085699-23-5
Catalog: |
BB065725 |
Product Name: |
(2E)-Ethyl 3-Ethoxy-2-methylprop-2-enoate |
CAS: |
1085699-23-5 |
Synonyms: |
ethyl (E)-3-ethoxy-2-methylacrylate; (E)-Ethyl 3-ethoxy-2-methylacrylate; ethyl 3-ethoxy-2-methylacrylate; ethyl (E)-3-ethoxy-2-methylprop-2-enoate; ethoxy ethyl methacrylate; ethyl3-ethoxy-2-methylacrylate |
IUPAC Name: | ethyl (E)-3-ethoxy-2-methylprop-2-enoate |
Description: | (2E)-Ethyl 3-Ethoxy-2-methylprop-2-enoate is a reagent used in the synthesis of respiratory synctial virus (RSV) fusion inhibitor in the treatment of respiratory illness, primarily in young children. |
Molecular Weight: | 158.19 |
Molecular Formula: | C8H14O3 |
Canonical SMILES: | CCOC=C(C)C(=O)OCC |
InChI: | InChI=1S/C8H14O3/c1-4-10-6-7(3)8(9)11-5-2/h6H,4-5H2,1-3H3/b7-6+ |
InChI Key: | WZCHIWJCAAITIC-VOTSOKGWSA-N |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 149 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 158.094294304 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 158.094294304 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 35.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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