| Identification | More | [Name]
4-Isoquinolineboronic acid pinacol ester | [CAS]
685103-98-4 | [Synonyms]
4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)ISOQUINOLINE
4-ISOQUINOLINEBORONIC ACID, PINACOL ESTER
ISOQUINOLINE-4-BORONIC ACID, PINACOL ESTER
2-(4-Isoquinolyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolane-2-yl)isoquinoline | [Molecular Formula]
C15H20BNO3 | [MDL Number]
MFCD05663891 | [Molecular Weight]
273.14 | [MOL File]
685103-98-4.mol |
| Chemical Properties | Back Directory | [Melting point ]
98-102 °C (lit.) | [Boiling point ]
397.5±15.0 °C(Predicted) | [density ]
1.10±0.1 g/cm3(Predicted) | [storage temp. ]
Inert atmosphere,2-8°C | [form ]
powder to crystal | [pka]
5.30±0.10(Predicted) | [color ]
White to Light yellow | [InChI]
InChI=1S/C15H18BNO2/c1-14(2)15(3,4)19-16(18-14)13-10-17-9-11-7-5-6-8-12(11)13/h5-10H,1-4H3 | [InChIKey]
LOMKRPABAXIQJL-UHFFFAOYSA-N | [SMILES]
C1C2=C(C=CC=C2)C(B2OC(C)(C)C(C)(C)O2)=CN=1 | [CAS DataBase Reference]
685103-98-4(CAS DataBase Reference) |
| Safety Data | Back Directory | [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:Wear suitable protective clothing . | [WGK Germany ]
3
| [HS Code ]
2933499090 | [Storage Class]
11 - Combustible Solids | [Hazard Classifications]
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3 |
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