Ethyl nonanoate - CAS 123-29-5
Catalog: |
BB005653 |
Product Name: |
Ethyl nonanoate |
CAS: |
123-29-5 |
Synonyms: |
ethyl nonanoate |
IUPAC Name: | ethyl nonanoate |
Description: | Ethyl nonanoate (CAS# 123-29-5) is a useful additive in analytical studies. However, it is not a suitable additive when used for detection of total serum protein or carbon dioxide content. |
Molecular Weight: | 186.29 |
Molecular Formula: | C11H22O2 |
Canonical SMILES: | CCCCCCCCC(=O)OCC |
InChI: | InChI=1S/C11H22O2/c1-3-5-6-7-8-9-10-11(12)13-4-2/h3-10H2,1-2H3 |
InChI Key: | BYEVBITUADOIGY-UHFFFAOYSA-N |
Boiling Point: | 119 °C (23 mmHg) |
Melting Point: | -44 °C |
Flash Point: | 202 |
Purity: | 99%+ |
Density: | 0.865 g/cm3 |
Appearance: | Colorless liquid |
Storage: | Store in a cool, dry place. Store in a tightly closed container. |
MDL: | MFCD00009570 |
LogP: | 3.30010 |
Refractive Index: | 1.422 |
Stability: | Stable under normal temperatures and pressures. May discolor on exposure to light. Hygroscopic: absorbs moisture or water from the air. |
Vapor Pressure: | 0.08 mm Hg ( 25 °C) |
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PMID | Publication Date | Title | Journal |
22520499 | 20120601 | Phytochemicals to suppress Fusarium head blight in wheat-chickpea rotation | Phytochemistry |
22277184 | 20120224 | Characterization of the volatile profile of Brazilian Merlot wines through comprehensive two dimensional gas chromatography time-of-flight mass spectrometric detection | Journal of chromatography. A |
21962269 | 20111115 | Drugs of abuse in oral fluid collected by two different sample kits--stability testing and validation using ultra performance tandem mass spectrometry analysis | Journal of chromatography. B, Analytical technologies in the biomedical and life sciences |
21204116 | 20111001 | A highly sensitive liquid chromatography tandem mass spectrometry method for simultaneous quantification of midazolam, 1'-hydroxymidazolam and 4-hydroxymidazolam in human plasma | Biomedical chromatography : BMC |
22272055 | 20110901 | First Steps Towards an Understanding of a Mode ofCarcinogenic Action for Vanadium Pentoxide | Journal of toxicologic pathology |
Complexity: | 121 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 186.16197994 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 186.16197994 |
Rotatable Bond Count: | 9 |
Topological Polar Surface Area: | 26.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4 |
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