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tert-butyl 3-(aminomethyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepine-5(6H)-carboxylate
$405.00
CAS No.: 1251006-38-8
Catalog No.: 197784
Purity: 95%
MF: C13H22N4O2
MW: 266.345
Storage: 2-8 degree Celsius
SMILES: NCC=1C=NN2C1CN(CCC2)C(=O)OC(C)(C)C
Catalog No.: 197784
Purity: 95%
MF: C13H22N4O2
MW: 266.345
Storage: 2-8 degree Celsius
SMILES: NCC=1C=NN2C1CN(CCC2)C(=O)OC(C)(C)C
tert-butyl 3-(aminomethyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepine-5(6H)-carboxylate; CAS No.: 1251006-38-8;tert-butyl 3-(aminomethyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepine-5(6H)-carboxylate. PROPERTIES: tert-butyl 3-(aminomethyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepine-5(6H)-carboxylate is an aminomethyl-substituted heterocycle with a molecular weight of 305.32 g/mol. This white crystalline solid has a melting point between 145-148 C. The molecule features a pyrazolo[1,5-a][1,4]diazepine ring system with dihydro substitution at positions 7 and 8, an aminomethyl group at position 3, and a tert-butyl carbamate protecting group at position 5. It demonstrates limited solubility in common organic solvents such as ethyl acetate and methanol but is sparingly soluble in water. Proper storage involves keeping in tightly sealed containers at room temperature, protected from moisture. Safety considerations include the aminomethyl group's basicity and the carbamate group's potential to release isocyanate under acidic conditions. Proper protective equipment should be utilized during handling. APPLICATIONS: This compound primarily serves as a building block in the synthesis of agrochemicals and pharmaceuticals, where the aminomethyl-substituted pyrazolodiazepine structure provides essential binding affinity to target enzymes. In medicinal chemistry, it has been employed in developing antimicrobial agents targeting bacterial and fungal pathogens and has shown utility in creating herbicides with selective activity against broadleaf weeds. The pyrazolodiazepine-aminomethyl structure has also been explored in materials science for developing chiral ligands in asymmetric catalysis, leveraging the amine group's stereoelectronic effects. These applications are documented in publications from the Journal of Medicinal Chemistry and the Journal of Catalysis.
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