3-Isoquinolinecarbonitrile
- CAS NO.：26947-41-1
- Empirical Formula: C10H6N2
- Molecular Weight: 154.17
- MDL number: MFCD00075136
- EINECS: 620-659-3
- SAFETY DATA SHEET (SDS)
- Update Date: 2023-05-25 10:25:48
What is 3-Isoquinolinecarbonitrile?
Chemical properties
White solid
The Uses of 3-Isoquinolinecarbonitrile
3-Isoquinolinecarbonitrile was employed as analytical standard to study the thermal degradation of 2-chlorobenzylidenemalononitrile (CS riot control agent) at elevated temperatures.
Definition
ChEBI: 3-Isoquinolinecarbonitrile is a member of isoquinolines.
Synthesis Reference(s)
Canadian Journal of Chemistry, 32, p. 641, 1954 DOI: 10.1139/v54-084
Properties of 3-Isoquinolinecarbonitrile
| Melting point: | 126-128 °C (lit.) |
| Boiling point: | 348.9±15.0 °C(Predicted) |
| Density | 1.21±0.1 g/cm3(Predicted) |
| storage temp. | Sealed in dry,Room Temperature |
| form | Crystalline Powder |
| pka | 0.57±0.30(Predicted) |
| color | White to yellow |
| Water Solubility | Insoluble in water. |
| BRN | 114887 |
| CAS DataBase Reference | 26947-41-1(CAS DataBase Reference) |
Safety information for 3-Isoquinolinecarbonitrile
| Signal word | Warning |
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
| Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P280:Wear protective gloves/protective clothing/eye protection/face protection. P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
Computed Descriptors for 3-Isoquinolinecarbonitrile
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