796061-07-9

Name 2-(TOLUENE-4-SULFONYLAMINO)PHENYLBORONIC ACID, PINACOL ESTER
CAS 796061-07-9
Molecular Formula C19H24BNO4S
MDL Number MFCD05663862
Molecular Weight 373.27
MOL File 796061-07-9.mol
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Chemical Properties

Melting point  135-139°C
Boiling point  505.0±60.0 °C(Predicted)
density  1.21±0.1 g/cm3(Predicted)
form  solid
pka 8.45±0.10(Predicted)
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

Safety Data

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

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