2-(Toluene-4-sulfonylamino)phenylboronic acid, pinacol ester Structure

2-(Toluene-4-sulfonylamino)phenylboronic acid, pinacol ester

Chemical Properties

Melting point 135-139°C
Boiling point 505.0±60.0 °C(Predicted)
Density  1.21±0.1 g/cm3(Predicted)
pka 8.45±0.10(Predicted)
form  solid
InChI 1S/C19H24BNO4S/c1-14-10-12-15(13-11-14)26(22,23)21-17-9-7-6-8-16(17)20-24-18(2,3)19(4,5)25-20/h6-13,21H,1-5H3
InChIKey XJERZPFENBAXMZ-UHFFFAOYSA-N
SMILES Cc1ccc(cc1)S(=O)(=O)Nc2ccccc2B3OC(C)(C)C(C)(C)O3
UNSPSC Code 12352103
NACRES NA.22

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H302
Precautionary statements P264-P270-P301+P312-P330-P501
Hazard Codes  Xn
Risk Statements  22
Safety Statements  36
WGK Germany  3
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
NFPA 704:
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