4-Oxo-2-oxetanecarboxylic Acid Ethyl Ester - CAS 150196-71-7
Catalog: |
BB058462 |
Product Name: |
4-Oxo-2-oxetanecarboxylic Acid Ethyl Ester |
CAS: |
150196-71-7 |
Synonyms: |
(±)-4-Oxo-2-oxetanecarboxylic Acid Ethyl Ester |
IUPAC Name: | ethyl 4-oxooxetane-2-carboxylate |
Description: | 4-Oxo-2-oxetanecarboxylic Acid Ethyl Ester is the ethyl ester derivative of 4-Oxo-2-oxetanecarboxylic Acid (O858455); a building block in copolymers which are used as coating materials for medical devices. |
Molecular Weight: | 144.13 |
Molecular Formula: | C6H8O4 |
Canonical SMILES: | CCOC(=O)C1CC(=O)O1 |
InChI: | InChI=1S/C6H8O4/c1-2-9-6(8)4-3-5(7)10-4/h4H,2-3H2,1H3 |
InChI Key: | MDARXXGXFUIFGZ-UHFFFAOYSA-N |
References: | Glauser, T., et al. U.S. Pat. Appl. Publ. US 20070005130 A1 20070104. Jan 4, 2007. |
Complexity: | 163 |
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: | 3 |
Topological Polar Surface Area: | 52.6Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.1 |
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