Ethyl pentadecanoate - CAS 41114-00-5
Catalog: |
BB024791 |
Product Name: |
Ethyl pentadecanoate |
CAS: |
41114-00-5 |
Synonyms: |
ethyl pentadecanoate |
IUPAC Name: | ethyl pentadecanoate |
Description: | Ethyl pentadecanoate (CAS# 41114-00-5) is a flavor and off-flavor compound that is found in cork stoppers produced by fungi. |
Molecular Weight: | 270.45 |
Molecular Formula: | C17H34O2 |
Canonical SMILES: | CCCCCCCCCCCCCCC(=O)OCC |
InChI: | InChI=1S/C17H34O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19-4-2/h3-16H2,1-2H3 |
InChI Key: | PTEYJUIKYIKULL-UHFFFAOYSA-N |
Boiling Point: | 158 °C / 5 mmHg |
Melting Point: | 41987 °C |
Purity: | > 97.0 % (GC) |
Density: | 0.859 g/cm3 |
Appearance: | Colorless liquid |
MDL: | MFCD00042872 |
LogP: | 5.64070 |
Publication Number | Title | Priority Date |
CN-113430085-A | Shaoxing yellow wine and method for accelerating aging of Shaoxing yellow wine | 20210624 |
CN-113341020-A | Flavor dimension-based white spirit similarity evaluation method | 20210621 |
CN-111647975-A | Novel spandex oil agent and spandex obtained through treatment of novel spandex oil agent | 20200728 |
CN-111849435-A | Biodiesel-based constant-current-variable drilling fluid containing intelligent temperature response type polymer | 20200715 |
CN-111849435-B | Biodiesel-based constant-current-variable drilling fluid containing intelligent temperature response type polymer | 20200715 |
Complexity: | 190 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 270.255880323 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 270.255880323 |
Rotatable Bond Count: | 15 |
Topological Polar Surface Area: | 26.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 7.3 |
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