720429

1H-Pyrazol-3-ylboronic acid hydrate

• Formule empirique (notation de Hill) : C₃H₅BN₂O₂ · xH₂O
• Poids moléculaire : 111.90 (anhydrous basis)
• Numéro MDL: MFCD11044442
• Code UNSPSC : 12352103
• ID de substance PubChem : 329763716
• Nomenclature NACRES : NA.22

Propriétés

• Forme: solid
• Pf: 88-93 °C
• Température de stockage: 2-8°C
• Chaîne SMILES: O.OB(O)c1cc[nH]n1
• InChI: 1S/C3H5BN2O2.H2O/c7-4(8)3-1-2-5-6-3;/h1-2,7-8H,(H,5,6);1H2
• Clé InChI: NXQCQMBEFQLICU-UHFFFAOYSA-N

Description

Description générale

1H-Pyrazol-3-ylboronic acid hydrate can be used as a reactant in the Suzuki-Miyaura coupling reaction to synthesize pyrazole derivatives by reacting with different aryl halides over the palladium catalyst.[1]

Application

Reactant for:

• Preparation of receiver-amplifier, self-immolative dendrimers as potential platform for self-triggered multiple-release prodrugs
• Preparation of bifunctional water-soluble triazole-containing derivatives of ethyl(hydroxycamptothecin) via click chemistry and conjugation to monoclonal antibodies for anticancer therapy

• Intermediate for synthesis of oligo(ethylene glycol)-terminated alkanethiol amides useful for biosensors

Informations sur la sécurité

• Pictogrammes: GHS07
• Mention d'avertissement: Warning
• Mentions de danger: H315,H319,H335
• Conseils de prudence: P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338
• Classification des risques: Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• Organes cibles: Respiratory system
• Code de la classe de stockage: 11 - Combustible Solids
• Classe de danger pour l'eau (WGK): WGK 3
• Point d'éclair (°F): Not applicable
• Point d'éclair (°C): Not applicable