Oxiran-2-ylmethyl Octanoate - CAS 24412-91-7
Catalog: |
BB058559 |
Product Name: |
Oxiran-2-ylmethyl Octanoate |
CAS: |
24412-91-7 |
Synonyms: |
OXIRAN-2-YLMETHYL OCTANOATE; (Oxiran-2-yl)methyl octanoate; glycidyl octanoate; Glycidyl Caprylate; caprylic acid glycidyl ester; Octanoic acid glycidyl ester |
IUPAC Name: | oxiran-2-ylmethyl octanoate |
Description: | Oxiran-2-ylmethyl Octanoate is a useful research chemical compound used as a reactant in the stereoselective synthesis of triacylglycerols. |
Molecular Weight: | 200.3 |
Molecular Formula: | C11H20O3 |
Canonical SMILES: | CCCCCCCC(=O)OCC1CO1 |
InChI: | InChI=1S/C11H20O3/c1-2-3-4-5-6-7-11(12)14-9-10-8-13-10/h10H,2-9H2,1H3 |
InChI Key: | CCNCFYINOYWDOK-UHFFFAOYSA-N |
Solubility: | Chloroform (Slightly), Ethyl Acetate (Slightly) |
Appearance: | Colourless OIl |
Storage: | 4°C |
References: | Sonnet, P.E. et al. Chem. Phys. Lipids, 58, 35 (1881). |
Complexity: | 168 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 200.1412445 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 200.1412445 |
Rotatable Bond Count: | 9 |
Topological Polar Surface Area: | 38.8Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
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