1005207-32-8

Name 4-BENZYLTHIOPHENYLBORONIC ACID
CAS 1005207-32-8
Molecular Formula C13H13BO2S
MDL Number MFCD06801692
Molecular Weight 244.12
MOL File 1005207-32-8.mol
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Chemical Properties

Melting point  148-149 °C(Solv: hexane (110-54-3))
Boiling point  435.4±55.0 °C(Predicted)
density  1.23±0.1 g/cm3(Predicted)
form  solid
pka 8.52±0.17(Predicted)
InChI 1S/C13H13BO2S/c15-14(16)12-6-8-13(9-7-12)17-10-11-4-2-1-3-5-11/h1-9,15-16H,10H2
InChIKey ALXFJPATEOZQPF-UHFFFAOYSA-N
SMILES OB(O)C(C=C1)=CC=C1SCC2=CC=CC=C2

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H319
Precautionary statements  P305+P351+P338
Hazard Codes  Xi
Risk Statements 
Safety Statements 
WGK Germany  WGK 3
HS Code  2934999090
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2

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