12-Hydroxydodecanoic acid - CAS 505-95-3
Catalog: |
BB027129 |
Product Name: |
12-Hydroxydodecanoic acid |
CAS: |
505-95-3 |
Synonyms: |
12-hydroxydodecanoic acid |
IUPAC Name: | 12-hydroxydodecanoic acid |
Description: | 12-Hydroxydodecanoic acid (CAS# 505-95-3) is used in the structural and functional characterization of S-nitrosoglutathione reductase from Solanum lycopersicum. |
Molecular Weight: | 216.32 |
Molecular Formula: | C12H24O3 |
Canonical SMILES: | C(CCCCCC(=O)O)CCCCCO |
InChI: | InChI=1S/C12H24O3/c13-11-9-7-5-3-1-2-4-6-8-10-12(14)15/h13H,1-11H2,(H,14,15) |
InChI Key: | ZDHCZVWCTKTBRY-UHFFFAOYSA-N |
Boiling Point: | 359.2 °C at 760 mmHg |
Melting Point: | 85.00 to 88.00 °C at 760.00 mm Hg |
Density: | 0.988 g/cm3 |
Solubility: | 278 mg/L at 25 °C (est) |
Appearance: | White to off-white powder |
MDL: | MFCD00002739 |
LogP: | 2.96430 |
Publication Number | Title | Priority Date |
JP-6844881-B1 | Treatment agent for synthetic fibers and synthetic fibers | 20200928 |
WO-2021205797-A1 | Cleaning solution for semiconductor substrate | 20200410 |
WO-2021202630-A2 | Recombinant bacteria producing chemicals inhibitory to salmonella invasion | 20200401 |
WO-2021202632-A2 | Compositions and methods for inhibiting vibrio infection | 20200401 |
WO-2021200930-A1 | Ball screw grease composition for rack-assisted electric power steering | 20200331 |
PMID | Publication Date | Title | Journal |
31721581 | 20200312 | An Agonist Radioligand for the Proinflammatory Lipid-Activated G Protein-Coupled Receptor GPR84 Providing Structural Insights | Journal of medicinal chemistry |
29976573 | 20180901 | A Specific Probe Substrate for Evaluation of CYP4A11 Activity in Human Tissue Microsomes and a Highly Selective CYP4A11 Inhibitor: Luciferin-4A and Epalrestat | The Journal of pharmacology and experimental therapeutics |
28729181 | 20170901 | Expression of CYP4V2 in human THP1 macrophages and its transcriptional regulation by peroxisome proliferator-activated receptor gamma | Toxicology and applied pharmacology |
22690147 | 20120401 | Mass spectrometry-based metabolomics to elucidate functions in marine organisms and ecosystems | Marine drugs |
21404247 | 20110401 | Production of new-to-nature sophorolipids by cultivating the yeast Candida bombicola on unconventional hydrophobic substrates | Biotechnology and bioengineering |
Complexity: | 146 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 216.17254462 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 216.17254462 |
Rotatable Bond Count: | 11 |
Topological Polar Surface Area: | 57.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.6 |
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