(2-Boc-aminophenyl)boronic acid, pinacol ester Structure

(2-Boc-aminophenyl)boronic acid, pinacol ester

Chemical Properties

Melting point 96-100 °C(lit.)
Boiling point 383.4±25.0 °C(Predicted)
Density  1.07±0.1 g/cm3(Predicted)
storage temp.  2-8°C
pka 14.00±0.70(Predicted)
form  solid
Appearance White to off-white Solid
InChI 1S/C17H26BNO4/c1-15(2,3)21-14(20)19-13-11-9-8-10-12(13)18-22-16(4,5)17(6,7)23-18/h8-11H,1-7H3,(H,19,20)
InChIKey LVHGGVGVAUJQBB-UHFFFAOYSA-N
SMILES CC(C)(C)OC(=O)Nc1ccccc1B2OC(C)(C)C(C)(C)O2
CAS DataBase Reference 159624-15-4(CAS DataBase Reference)
UNSPSC Code 12352103

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H302-H315-H319-H335
Precautionary statements P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
WGK Germany  3
HS Code  2931900090
Storage Class 13 - Non Combustible Solids
NFPA 704:
1
2 0

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(2-Boc-aminophenyl)boronic acid, pinacol ester Spectrum