| Identification | More | [Name]
3,5-Dimethylisoxazole-4-boronic acid pinacol ester | [CAS]
832114-00-8 | [Synonyms]
3,5-DIMETHYL-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)ISOXAZOLE
3,5-DIMETHYL-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE-2-YL)ISOXAZOLE
3,5-DIMETHYL-ISOXAZOLE-4-BORONIC ACID PINACOL ESTER
3,5-DIMETHYLISOXAZOLEBORONIC ACID PINACOL ESTER
3,5-Dimethylisoxazole-4-boronic acid pinacol ester 97%
(3,5-Dimethyl-4-isoxazolyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
3,5-Dimethyl-4-isoxazoleboronic Acid Pinacol Ester
3,5-Dimethylisoxazoleboronic acid pinacol ester, 3,5-Dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolane-2-yl)isoxazole | [Molecular Formula]
C11H20BNO4 | [MDL Number]
MFCD05863910 | [Molecular Weight]
241.09 | [MOL File]
832114-00-8.mol |
| Chemical Properties | Back Directory | [Melting point ]
95-99 °C(lit.) | [Boiling point ]
324.7±42.0 °C(Predicted) | [density ]
1.05±0.1 g/cm3(Predicted) | [storage temp. ]
Keep in dark place,Sealed in dry,Room Temperature | [form ]
Solid | [pka]
-1.50±0.28(Predicted) | [color ]
White to pale brown | [InChI]
InChI=1S/C11H18BNO3/c1-7-9(8(2)14-13-7)12-15-10(3,4)11(5,6)16-12/h1-6H3 | [InChIKey]
CVLHETBAROWASE-UHFFFAOYSA-N | [SMILES]
O1C(C)=C(B2OC(C)(C)C(C)(C)O2)C(C)=N1 | [CAS DataBase Reference]
832114-00-8(CAS DataBase Reference) |
| Safety Data | Back Directory | [Symbol(GHS) ]
GHS07 | [Signal word ]
Warning | [Hazard statements ]
H315-H319-H335 | [Precautionary statements ]
P261-P280a-P304+P340-P305+P351+P338-P405-P501a | [Hazard Codes ]
Xi | [Risk Statements ]
R36/37/38:Irritating to eyes, respiratory system and skin . | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection . | [WGK Germany ]
3
| [Hazard Note ]
Irritant | [HS Code ]
29349990 | [Storage Class]
11 - Combustible Solids |
| Hazard Information | Back Directory | [Uses]
3,5-Dimethylisoxazole-4-boronic acid, pinacol ester | [Reactions]
The coupling of 3-bromoquinoline with 3,5-dimethylisoxazole-4-boronic acid pinacol ester provided an example of a challenging Suzuki–Miyaura coupling reaction involving the coupling of two heteroaryl substrates[1]. | [References]
[1] Reizman, B. J., Wang, Y.-M., Buchwald, S. L., & Jensen, K. F. (2016). Suzuki–Miyaura cross-coupling optimization enabled by automated feedback. Reaction Chemistry & Engineering, 6, 658–666. https://doi.org/10.1039/C6RE00153J
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