Cyclohexylacetylene - CAS 931-48-6
Catalog: |
BB040792 |
Product Name: |
Cyclohexylacetylene |
CAS: |
931-48-6 |
Synonyms: |
ethynylcyclohexane |
IUPAC Name: | ethynylcyclohexane |
Description: | Cyclohexylacetylene (CAS# 931-48-6) is a useful research chemical. |
Molecular Weight: | 108.18 |
Molecular Formula: | C8H12 |
Canonical SMILES: | C#CC1CCCCC1 |
InChI: | InChI=1S/C8H12/c1-2-8-6-4-3-5-7-8/h1,8H,3-7H2 |
InChI Key: | SSDZYLQUYMOSAK-UHFFFAOYSA-N |
Appearance: | Colorless clear liquid |
MDL: | MFCD00001513 |
LogP: | 2.19990 |
GHS Hazard Statement: | H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids] |
Precautionary Statement: | P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-113501835-A | Aluminium chloride catalyzed end group alkyne dehydroboronization method | 20210712 |
CN-113368870-A | Sulfur ligand modified monoatomic catalyst and preparation method and application thereof | 20210709 |
CN-113248455-A | 3, 5-disubstituted isoxazole derivatives and synthesis method thereof | 20210525 |
CN-113292561-A | Compound with dipyrrolopyridine structure, preparation method and medical application | 20210522 |
CN-113149926-A | Preparation method of 3, 5-disubstituted isoxazole derivative | 20210430 |
PMID | Publication Date | Title | Journal |
16551104 | 20060329 | Assembly of an allenylidene ligand, a terminal alkyne, and an acetonitrile molecule: formation of osmacyclopentapyrrole derivatives | Journal of the American Chemical Society |
18404502 | 20050601 | 2- and 8-alkynyl-9-ethyladenines: Synthesis and biological activity at human and rat adenosine receptors | Purinergic signalling |
Complexity: | 98.5 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 108.093900383 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 108.093900383 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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