5-(Chloromethyl)-7-oxo-4,7-dihydropyrazolo[1,5-a]pyrimidine-3-carbonitrile

Base Information

• Chemical Name: 5-(Chloromethyl)-7-oxo-4,7-dihydropyrazolo[1,5-a]pyrimidine-3-carbonitrile
• CAS No.: 329213-60-7
• Molecular Formula: C8H5ClN4O
• Molecular Weight: 208.60400
• Hs Code.: 2933990090
• European Community (EC) Number: 859-910-9
• DSSTox Substance ID: DTXSID80350757
• Wikidata: Q72453889
• Mol file: 329213-60-7.mol

Synonyms:329213-60-7;5-(chloromethyl)-7-oxo-4,7-dihydropyrazolo[1,5-a]pyrimidine-3-carbonitrile;5-(chloromethyl)-7-hydroxypyrazolo[1,5-a]pyrimidine-3-carbonitrile;5-(chloromethyl)-4,7-dihydro-7-oxo-Pyrazolo[1,5-a]pyrimidine-3-carbonitrile;925675-85-0;5-(chloromethyl)-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile;MFCD01451972;5-(Chloromethyl)-4,7-dihydro-7-oxopyrazolo[1,5-a]pyrimidine-3-carbonitrile;5-(Chloromethyl)-7-oxo-1,7-dihydropyrazolo[1,5-a]pyrimidine-3-carbonitrile;2168302-19-8;AMY5563;DTXSID80350757;5-(Chloromethyl)-7-oxo-4H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile;BBL011546;STK930449;STL146671;AKOS005660694;AKOS005721020;5-(Chloromethyl)-4,7-dihydro-7-oxo-pyrazolo-[1,5-a]pyrimidine-3-carbonitrile;AC-31856;AS-32678;CS-0080909;FT-0738767;EN300-41254;A875481;Z1336404289;Pyrazolo[1,5-a]pyrimidine-3-carbonitrile, 5-(chloromethyl)-7-hydroxy-;5-(CHLOROMETHYL)-7-OXO-4,7-DIHYDROPYRAZOLO[1,5-A]PYRIMIDIN-3-YL CYANIDE

Chemical Property of 5-(Chloromethyl)-7-oxo-4,7-dihydropyrazolo[1,5-a]pyrimidine-3-carbonitrile

Chemical Property:

• PSA: 73.95000
• Density: 1.63
• LogP: 0.63308
• XLogP3: 0
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 208.0151885
• Heavy Atom Count: 14
• Complexity: 440

Purity/Quality:

98%min ^*data from raw suppliers

5-(chloromethyl)-7-oxo-4,7-dihydropyrazolo[1,5-a]pyrimidine-3-carbonitrile ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(N=C2C(=CNN2C1=O)C#N)CCl