| Identification | Back Directory | [Name]
1-CYANOACETYL-3,5-DIMETHYLPYRAZOLE | [CAS]
36140-83-7 | [Synonyms]
AKOS BBS-00006743
1-CYANOACETYL-3,5-DIMETHYLPYRAZOLE
1-Cyanoacetyl-3,5-Dimethylpyrazole,>98%
1-Cyanoacetyl-3,5-dimethyl-1H-pyrazole, 97%
3-(3,5-dimethylpyrazol-1-yl)-3-oxopropanenitrile
3-(3,5-dimethyl-1-pyrazolyl)-3-oxopropanenitrile
3-(3,5-dimethylpyrazol-1-yl)-3-keto-propionitrile
3-(3,5-dimethylpyrazol-1-yl)-3-oxo-propanenitrile
1H-Pyrazole-1-propanenitrile, 3,5-dimethyl-β-oxo-
3-(3,5-DIMETHYL-1H-PYRAZOL-1-YL)-3-OXOPROPANENITRILE | [Molecular Formula]
C8H9N3O | [MDL Number]
MFCD00051954 | [MOL File]
36140-83-7.mol | [Molecular Weight]
163.18 |
| Chemical Properties | Back Directory | [Melting point ]
116-119°C | [Boiling point ]
331.4±44.0 °C(Predicted) | [density ]
1.16±0.1 g/cm3(Predicted) | [storage temp. ]
2-8°C, stored under nitrogen | [pka]
5.37±0.10(Predicted) | [Appearance]
White to off-white Solid | [Sensitive ]
Hygroscopic | [BRN ]
6286 | [InChI]
InChI=1S/C8H9N3O/c1-6-5-7(2)11(10-6)8(12)3-4-9/h5H,3H2,1-2H3 | [InChIKey]
DDWZYWSLHBDVGR-UHFFFAOYSA-N | [SMILES]
C(N1N=C(C)C=C1C)(=O)CC#N |
| Hazard Information | Back Directory | [Uses]
1-Cyanoacetyl-3,5-dimethyl-1H-pyrazole is used in pharma industry. | [Synthesis]
Treatment of cyanoacetic acid hydrazide (2) in water containing a catalytic amount of conc. HCl with acetyl acetone at room
temperature afforded 1-cyanoacetyl-3, 5-dimethyl pyrazole 5[1].
 | [References]
[1] S. Bondock, A. F., Abd El-Gaber El-Tarhoni. (2006). Utility of cyanoacetic acid hydrazide in heterocyclic synthesis. Arkivoc, 2006 1. https://doi.org/10.3998/ark.5550190.0007.905 |
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| Company Name: |
Alfa Aesar
|
| Telephone: |
400-6106006 |
| Website: |
http://chemicals.thermofisher.cn |
| Company Name: |
Energy Chemical
|
| Telephone: |
400-0056266 |
| Website: |
www.energy-chemical.com |
|