Cyclohexyl isocyanide
ALDRICH/133302 - 98%
Synonym: Isocyanocyclohexane
CAS Number: 931-53-3
Empirical Formula (Hill Notation): C7H11N
Molecular Weight: 109.17
EC Number: 213-238-7
MDL Number: MFCD00003839
Linear Formula: C6H11NC
Product Type: Chemical
| assay | 98% |
| density | 0.878 g/mL at 25 °C (lit.) |
| form | liquid |
| InChI | 1S/C7H11N/c1-8-7-5-3-2-4- |
| InChI key | XYZMOVWWVXBHDP-UHFFFAOYSA |
| Quality Level | 100  |
| refractive index | n |
| SMILES string | [C-]#[N+]C1CCCCC1 |
| storage temp. | 2-8°C |
| Application: | • Isocyanide in coordination chemistry: The study on mixed "2 + 1" tricarbonyl dithiocarbamate complexes highlights Cyclohexyl isocyanide′s role as an effective monodentate ligand, contributing to advancements in radiopharmaceutical applications using Re, Tc, and Re isotopes (Shegani et al., 2021  ).• Organic synthesis reagent in vascular treatments: The article discusses the use of Cyclohexyl isocyanide in modifying the endocannabinoid system, emphasizing its potential in developing treatments for conditions like hypertension through biochemical pathway modulation (Baranowska-Kuczko et al., 2021 ).• Chemical process optimization in dye decolorization: Cyclohexyl isocyanide plays a crucial role in the covalent immobilization of enzymes used for the decolorization of textile dyes, demonstrating its utility in environmental chemistry and industrial applications related to pollution control (Salami et al., 2018 ).• Application in nanocellulose modification: Demonstrates the versatility of Cyclohexyl isocyanide in nanotechnology by facilitating the covalent attachment of temperature-responsive polymers to cellulose nanofibrils, enhancing the material′s properties for use in smart textiles and responsive materials (Khine et al., 2018 ). |
| General description: | Cyclohexyl isocyanide reacts with dimethyl acetylenedicarboxylate to give a mixture of cyclopenta[b]pyridine derivatives, azaspirononatriene derivative and the azabicyclononatriene. It reacts with dialkyl acetylenedicarboxylates to form 1:1 intermediate which on facile addition to 1-benzylisatin and tryptantrin yields highly functionalized novel unsaturated γ-spiroiminolactones. |
| Packaging: | 1, 5 g in ampule |
| Hazard Codes | T |
| Risk Statements | 23/24/25 |
| Safety Statements | 24/25-45 |
| RIDADR | UN 2810 6.1 / PGII |
| WGK Germany | WGK 3 |
| Flash Point(F) | 170.6 °F - closed cup |
| Flash Point(C) | 77 °C - closed cup |
| Purity | 98% |
| Density | 0.878 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| Storage Temp. | 2-8°C |
| UNSPSC | 12352100 |