3-Oxobutanenitrile
- CAS NO.：2469-99-0
- Empirical Formula: C4H5NO
- Molecular Weight: 83.09
- MDL number: MFCD05861381
- EINECS: 219-590-8
- SAFETY DATA SHEET (SDS)
- Update Date: 2023-11-08 14:36:47
What is 3-Oxobutanenitrile?
Chemical properties
Acetylacetonitrile [2469-99-0], b-ketobutyronitrile, 3-oxo-butanenitrile, H3CCOCCH2 CN, Mr 83.09, bp 120 – 125℃ (101.3 kPa), can be obtained by hydrolysis of b-aminocrotononitrile. A potential application is the synthesis of 3-amino-5-methylisoxazole, which is an intermediate for various drugs.
The Uses of 3-Oxobutanenitrile
3-?Oxobutanenitrile is a reagent used in the synthesis of pyrazolopyrimidinones as well as in the preparation of inhibitors of phosphopantetheine
Properties of 3-Oxobutanenitrile
| Boiling point: | 92-94℃/10mm |
| Density | 0.976±0.06 g/cm3(Predicted) |
| refractive index | 1.4285 |
| storage temp. | Inert atmosphere,Store in freezer, under -20°C |
| form | Liquid |
| pka | 10.31±0.10(Predicted) |
| color | Colorless to pale yellow |
| Water Solubility | Slightly soluble in water. |
| CAS DataBase Reference | 2469-99-0 |
Safety information for 3-Oxobutanenitrile
| Signal word | Danger |
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H302:Acute toxicity,oral H312:Acute toxicity,dermal H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H332:Acute toxicity,inhalation 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. P304+P340:IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. P405:Store locked up. |
Computed Descriptors for 3-Oxobutanenitrile
New Products
Tubulysin F Tubulysin H Tubulysin M Tubulysin B (R)-tert-butyl (4-methyl-1-oxopentan-3-yl)carbamate Diethyl Aluminium Cyanide (1.0 M in Toluene) CYCLOBUTYLAMINE HYDROCHLORIDE 1-(1,1-Difluoroethyl)-2-fluorobenzene 3-N-BOC-(S)-AMINO BUTYRONITRILE 3-METHYLAZETIDIN-3-OL HYDROCHLORIDE 4,4-DIFLUOROPIPERIDINE 2,2-Difluoropropylamine hydrochloride Imeglimin Hydrochloride IH 2-(1-(Mercaptomethyl) cyclopropyl) acetonitrile Fuel shell 2-[[(3aR,4S,6R,6aS)-6-Aminotetrahydro-2,2-dimethyl-4H-cyclopenta-1,3-dioxol-4-yl]oxy]ethanol ethanedioate (1R,2S)-2-(3,4-Difluorophenyl)cyclopropanamine 2-[2-[3(S)-3[2-(7-chloro-2-quinolinyl) ethenyl] phenyl-3- hydroxyl propyl] phenyl]-2-propanol (R)-1-Aminoindan Hydrochloride 2,3-dichloro-6- nitrobenzonitrile Lubiprostone Magnesium Trisilicate Latanoprostene Bunod Flame Retardant Zinc BorateRelated products of tetrahydrofuran
You may like
-
Fuel shell 98%View Details -
4,6-dichloro-2-propylthiopyrimidine-5-amine 145783-15-9 98%View Details
145783-15-9 -
109113-72-6 2-(Chloromethyl)-4-methylquinazoline (2-CMQ) 98%View Details
109113-72-6 -
Hydrogen Gas 98%View Details
-
590-17-0 Bromoacetonitrile 98%View Details
590-17-0 -
151767-02-1 Montelukast Sodium IP/USP 98%View Details
151767-02-1 -
Valacyclovir Hydrochloride IH 98%View Details
124832-27-5 -
2-[2-[3(S)-3[2-(7-chloro-2-quinolinyl) ethenyl] phenyl-3- hydroxyl propyl] phenyl]-2-propanol 98%View Details
142569-70-8
Statement: All products displayed on this website are only used for non medical purposes such as industrial applications or scientific research, and cannot be used for clinical diagnosis or treatment of humans or animals. They are not medicinal or edible.