1,3,6-HEXANETRICARBONITRILE
- CAS NO.：1772-25-4
- Empirical Formula: C9H11N3
- Molecular Weight: 161.2
- MDL number: MFCD00129792
- EINECS: 217-199-7
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-12-18 14:08:57
What is 1,3,6-HEXANETRICARBONITRILE?
The Uses of 1,3,6-HEXANETRICARBONITRILE
1,3,6-Hexanetricarbonitrile is mainly used as an intermediate in organic synthesis, as a high boiling point solvent and as an additive to electrolytes.
Flammability and Explosibility
Not classified
Synthesis
Preparation of 1,3,6-hexanetricarbonitrile: To a solution of 1,6-dicyano-2-butylene (1,6-dicyano-2-butylene) ) And HCI methyl alcohol solution were reacted at 40-60 ° C for 4-6h, NaCN was added and the reaction was carried out at 40-101 ° C to obtain 1,3,6-hexanetricarbonitrile.
Properties of 1,3,6-HEXANETRICARBONITRILE
| Boiling point: | 255-260 °C2 mm Hg(lit.) |
| Density | 1.04 g/mL at 25 °C(lit.) |
| vapor pressure | 2Pa at 25℃ |
| refractive index | n |
| Flash point: | 185 °F |
| form | clear liquid |
| color | Light yellow to Yellow to Orange |
| Water Solubility | 16.85g/L at 20℃ |
| InChI | InChI=1S/C9H11N3/c10-6-2-1-4-9(8-12)5-3-7-11/h9H,1-5H2 |
| EPA Substance Registry System | 1,3,6-Hexanetricarbonitrile (1772-25-4) |
Safety information for 1,3,6-HEXANETRICARBONITRILE
| Signal word | Danger |
| Pictogram(s) |
 Skull and Crossbones Acute Toxicity GHS06  Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H227:Flammable liquids H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation |
| Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P270:Do not eat, drink or smoke when using this product. P271:Use only outdoors or in a well-ventilated area. P280:Wear protective gloves/protective clothing/eye protection/face protection. P370+P378:In case of fire: Use … for extinction. P405:Store locked up. P403+P233:Store in a well-ventilated place. Keep container tightly closed. P501:Dispose of contents/container to..… |
Computed Descriptors for 1,3,6-HEXANETRICARBONITRILE
| InChIKey | LNLFLMCWDHZINJ-UHFFFAOYSA-N |
| SMILES | C(C#N)CC(C#N)CCCC#N |
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