1-Heptylimidazole - CAS 53657-09-3
Catalog: |
BB028303 |
Product Name: |
1-Heptylimidazole |
CAS: |
53657-09-3 |
Synonyms: |
1-heptylimidazole; 1-heptylimidazole |
IUPAC Name: | 1-heptylimidazole |
Description: | 1-Heptylimidazole (CAS# 53657-09-3) is a useful research chemical compound. |
Molecular Weight: | 166.26 |
Molecular Formula: | C10H18N2 |
Canonical SMILES: | CCCCCCCN1C=CN=C1 |
InChI: | InChI=1S/C10H18N2/c1-2-3-4-5-6-8-12-9-7-11-10-12/h7,9-10H,2-6,8H2,1H3 |
InChI Key: | NQQMTFKCFYHSBJ-UHFFFAOYSA-N |
Boiling Point: | 286.2 °C at 760 mmHg |
Density: | 0.92 g/cm3 |
Appearance: | Colorless to light yellow clear liquid |
LogP: | 2.85350 |
Publication Number | Title | Priority Date |
CN-112126047-A | Degradable biopolymer capable of being derived from biomass and preparation method thereof | 20201008 |
JP-2021115476-A | Odor substance adsorbent | 20200121 |
CN-110878053-A | Preparation method of dialkyl imidazole bis (trifluoromethyl) sulfonyl imide salt | 20191205 |
CN-112409766-A | Blend material based on bio-based polylactic acid and ionomer elastomer and preparation method thereof | 20190820 |
US-10712105-B1 | Heat transfer fluids and methods of use | 20190619 |
PMID | Publication Date | Title | Journal |
22594615 | 20120607 | Molecular simulation of the thermophysical properties of N-functionalized alkylimidazoles | The journal of physical chemistry. B |
14611845 | 20030901 | Synthesis of N-alkylated derivatives of imidazole as antibacterial agents | Bioorganic & medicinal chemistry letters |
Complexity: | 104 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 166.146998583 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 166.146998583 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 17.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
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